data_1te4_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 1te4 _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 ' 23' ' ' ALA . . . . . 0.439 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 CA--C 1.519 -0.215 0 CA-C-O 120.734 0.302 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.448 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 2.5 t80 -63.2 -51.57 65.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.244 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -63.4 -55.25 37.08 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.832 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.439 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 44.2 Cg_exo -50.91 -24.9 14.64 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 121.782 1.654 . . . . 0.0 110.349 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.666 HD21 HG13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -76.4 -41.75 46.77 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 114.207 -1.361 . . . . 0.0 109.218 178.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.628 HD21 ' HD2' ' A' ' 53' ' ' ARG . 16.5 tp -70.47 -27.14 63.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.207 178.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -65.93 -41.11 91.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.124 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -61.38 -17.77 55.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.035 -0.53 . . . . 0.0 112.008 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.6 HD13 HD12 ' A' ' 28' ' ' LEU . 80.1 mt -69.37 -11.89 61.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.788 0.328 . . . . 0.0 111.333 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.2 t -109.82 0.82 18.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.825 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -67.92 139.03 56.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.722 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -67.53 -24.03 65.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.315 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.67 139.79 33.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.919 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.1 p-90 -88.1 -26.4 22.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -64.08 -41.55 97.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.004 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.7 mt -80.18 -41.54 21.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.811 0.338 . . . . 0.0 111.122 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 -59.48 -24.52 63.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.592 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.31 -63.61 3.85 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.635 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.61 -37.9 6.05 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.652 0.263 . . . . 0.0 111.258 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.429 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -57.45 -54.21 49.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.323 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.409 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -63.35 -30.81 71.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.703 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -68.47 -34.45 75.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.906 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.0 mt -99.37 -19.36 5.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.343 . . . . 0.0 111.762 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.666 HG13 HD21 ' A' ' 27' ' ' LEU . 3.9 tt -58.38 -34.92 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.24 -17.11 80.27 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.138 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -70.58 -7.15 41.87 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -99.18 -22.17 15.77 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.472 ' HG3' HG21 ' A' ' 80' ' ' ILE . 1.7 mp0 55.96 54.4 8.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 111.391 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -127.47 166.92 17.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.809 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -63.6 -29.11 70.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.628 ' HD2' HD21 ' A' ' 28' ' ' LEU . 1.1 ttp180 -66.33 -11.69 52.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.965 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.468 ' HB1' HG22 ' A' ' 46' ' ' ILE . . . -104.94 -13.59 15.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 86.8 t -68.9 -51.31 45.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.088 -179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.467 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 21.1 tt0 -59.75 -49.63 90.76 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.467 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.2 Cg_exo -41.22 -52.24 3.6 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.371 2.047 . . . . 0.0 112.898 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.517 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . 5.2 mt -60.03 -36.93 78.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.384 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.6 mm -55.02 -59.83 2.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.875 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.463 ' HG3' HD11 ' A' ' 61' ' ' LEU . 3.9 ptpp? -70.76 -40.12 72.87 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.64 ' HG ' HG13 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -57.86 -51.58 69.03 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.465 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.477 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 33.5 mt -55.96 -10.34 0.77 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.716 0.294 . . . . 0.0 111.491 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.02 -20.32 13.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.991 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.13 -40.3 93.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.714 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.437 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 29.5 t70 62.33 27.35 16.34 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.316 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 4.7 m -84.31 17.12 2.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.477 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.79 -96.58 0.68 Allowed Glycine 0 C--O 1.227 -0.337 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.747 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.09 -43.8 64.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.036 0.446 . . . . 0.0 110.61 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.64 HG13 ' HG ' ' A' ' 61' ' ' LEU . 21.8 t -73.35 -39.09 54.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.049 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.477 ' HG2' ' HA ' ' A' ' 62' ' ' LEU . 3.0 tmm_? -77.98 -63.6 1.35 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.668 0.27 . . . . 0.0 111.435 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 48.9 m -51.55 -32.25 27.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.305 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.411 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -63.4 -38.39 96.31 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.437 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.517 ' HB3' ' HA ' ' A' ' 58' ' ' LEU . . . -64.02 -37.37 87.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.704 0.288 . . . . 0.0 111.042 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.16 -57.14 14.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.762 -179.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 75' ' ' ARG . 7.4 ptm85 -58.65 -26.93 64.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.618 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.2 m -58.49 -39.85 81.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.452 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.536 ' HG ' HG13 ' A' ' 85' ' ' VAL . 6.1 mp -59.79 -58.33 9.03 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.744 0.307 . . . . 0.0 110.631 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.446 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 54.1 mt-10 -48.96 -31.17 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.338 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -68.67 -41.93 78.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.141 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.472 HG21 ' HG3' ' A' ' 50' ' ' GLN . 35.3 mt -74.35 -60.87 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 63.14 117.6 0.01 OUTLIER Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.977 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.435 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 145.43 -173.05 25.98 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.753 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -69.45 -30.2 68.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.814 0.34 . . . . 0.0 110.902 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.51 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -52.85 -63.24 1.21 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.851 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.536 HG13 ' HG ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -70.93 -20.61 21.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.9 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.445 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 55.3 ttp180 -56.78 -26.35 57.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.253 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.16 -25.67 27.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.215 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.62 69.41 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.695 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.452 ' HE2' ' HB3' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -69.09 -26.79 65.11 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.249 179.629 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 41.7 mt-10 -69.78 -32.26 70.64 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -76.76 -28.7 55.82 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.622 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.464 HD23 HD11 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -84.54 -30.08 25.39 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.515 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.57 -20.27 66.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.337 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -80.33 -26.86 38.54 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.674 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 51.3 p -118.2 24.4 10.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.827 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.422 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -55.85 116.41 7.19 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.338 -0.846 . . . . 0.0 113.261 -179.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.3 t -140.52 130.24 24.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.828 0.347 . . . . 0.0 110.842 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.86 -135.67 51.79 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.631 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -67.64 -32.01 72.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.618 0.247 . . . . 0.0 111.315 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.411 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.84 -28.75 37.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.687 -179.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.422 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 21.9 ttp180 -75.22 -55.23 5.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.431 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -48.25 -26.95 2.19 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.21 0.529 . . . . 0.0 110.256 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.411 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 37.5 t -59.5 -60.04 3.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.868 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.45 ' CB ' ' HB2' ' A' ' 89' ' ' MET . . . -62.59 -56.55 16.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.433 0.635 . . . . 0.0 111.957 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.586 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 54.8 t -52.38 -54.61 14.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 114.82 -1.082 . . . . 0.0 113.146 -178.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -70.74 -31.48 68.32 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.446 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 21.6 t80 -63.7 -50.96 67.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 4.3 pp -52.42 -15.02 0.55 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.456 -178.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -62.2 -13.71 30.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.088 0.47 . . . . 0.0 110.149 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.02 12.97 6.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.77 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.044 -0.979 . . . . 0.0 111.074 179.88 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.557 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.193 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.559 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -60.96 -53.86 52.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.154 0.502 . . . . 0.0 110.124 179.661 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -63.23 -54.92 40.97 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.013 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.557 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 91.9 Cg_exo -43.33 -26.38 0.93 Allowed 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.228 1.952 . . . . 0.0 111.458 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 43.5 mt -74.68 -55.3 6.03 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.937 178.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.56 HD11 HD13 ' A' ' 31' ' ' LEU . 38.1 tp -61.53 -20.96 63.81 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.599 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -80.68 -36.81 31.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.715 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.469 ' HB3' HG21 ' A' ' 38' ' ' ILE . 60.0 m -66.22 -42.42 88.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.859 -179.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.56 HD13 HD11 ' A' ' 28' ' ' LEU . 4.1 pp -63.32 -6.27 4.46 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.2 m -90.32 22.12 3.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.066 0.46 . . . . 0.0 110.525 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -117.5 144.58 44.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.029 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -65.89 -8.76 23.96 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.305 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -77.36 120.69 22.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.947 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -70.68 -35.88 73.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.827 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 53.1 ttp180 -60.11 -54.63 43.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.254 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.469 HG21 ' HB3' ' A' ' 30' ' ' SER . 64.0 mt -65.96 -45.65 90.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.804 0.335 . . . . 0.0 111.0 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.495 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.3 ttm180 -63.2 -20.69 65.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.58 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.65 -66.48 2.27 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.625 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.6 -40.31 19.03 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.688 0.28 . . . . 0.0 111.18 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.99 -52.72 63.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.075 0.464 . . . . 0.0 110.235 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.31 -36.19 82.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.665 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -63.16 -26.28 68.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.471 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 62.8 mt -99.26 -19.74 5.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.005 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.568 HG21 ' HB3' ' A' ' 54' ' ' ALA . 0.9 OUTLIER -55.39 -39.54 53.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.535 -179.738 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.19 -16.48 73.17 Favored Glycine 0 C--N 1.329 0.193 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.744 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.684 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.7 OUTLIER -64.0 -45.93 86.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.831 0.348 . . . . 0.0 110.379 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.482 ' C ' ' H ' ' A' ' 51' ' ' ASP . 85.2 m-85 -85.54 111.87 20.41 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.659 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.698 ' H ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -74.67 35.02 0.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.377 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.482 ' H ' ' C ' ' A' ' 49' ' ' PHE . 35.6 t70 -100.66 155.31 17.96 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.84 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -63.06 -23.58 67.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.544 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.445 ' NH1' ' HB2' ' A' ' 28' ' ' LEU . 0.9 OUTLIER -57.69 -41.15 81.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.81 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.568 ' HB3' HG21 ' A' ' 46' ' ' ILE . . . -97.37 24.55 6.41 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.7 p -91.41 -37.75 9.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.941 0.4 . . . . 0.0 111.062 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.506 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 24.8 tt0 -60.45 -51.13 82.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.98 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.553 ' HG2' HG12 ' A' ' 46' ' ' ILE . 88.5 Cg_exo -42.81 -52.36 4.67 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.397 2.065 . . . . 0.0 112.761 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' A' ' 73' ' ' ALA . 49.6 mt -56.73 -41.23 77.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.596 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 25.3 mm -53.17 -60.12 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -71.87 -31.04 66.06 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.492 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -66.08 -44.19 85.15 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.549 HD13 HD13 ' A' ' 92' ' ' LEU . 12.0 mt -62.68 -8.96 7.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.967 0.413 . . . . 0.0 110.564 -178.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -126.95 -6.2 6.15 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.27 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -61.17 -33.05 72.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.28 0.562 . . . . 0.0 110.745 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 42.7 m-20 58.75 25.75 13.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.292 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.417 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.1 m -86.04 5.59 32.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.623 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.98 -103.95 2.63 Favored Glycine 0 C--O 1.227 -0.306 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.44 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -50.44 -39.79 48.58 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.182 0.515 . . . . 0.0 110.127 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.492 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.4 t -67.98 -38.29 79.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.539 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.431 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 27.0 ttp180 -76.61 -58.87 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.294 -179.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 62.0 p -50.87 -30.18 13.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.326 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.17 -37.02 94.23 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.616 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.461 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -77.08 -36.92 55.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.61 0.243 . . . . 0.0 111.507 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.405 ' HB3' ' HE1' ' A' ' 99' ' ' PHE . . . -54.98 -49.59 71.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.799 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.42 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 7.3 ptp180 -73.68 -33.8 64.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.283 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.502 ' HA ' HE21 ' A' ' 79' ' ' GLN . 19.8 m -56.5 -39.97 74.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.034 -179.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.1 mt -55.51 -59.58 4.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.747 0.308 . . . . 0.0 110.53 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -49.08 -29.99 5.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.804 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.502 HE21 ' HA ' ' A' ' 76' ' ' SER . 24.9 mt-30 -68.68 -41.71 78.86 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.949 0.404 . . . . 0.0 110.257 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.525 HG22 ' HD2' ' A' ' 84' ' ' ARG . 71.6 mt -69.22 -61.48 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.12 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.463 ' HA2' ' HH ' ' A' ' 107' ' ' TYR . . . 58.94 111.3 0.01 OUTLIER Glycine 0 CA--C 1.518 0.27 0 C-N-CA 121.156 -0.545 . . . . 0.0 113.155 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 165.83 174.26 35.15 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.593 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.93 -22.59 66.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.834 0.349 . . . . 0.0 110.547 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.602 ' HD3' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -75.76 -33.7 60.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.619 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.602 ' N ' ' HD3' ' A' ' 84' ' ' ARG . 3.4 t -68.53 -32.68 56.29 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-O 121.333 0.587 . . . . 0.0 109.756 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 86' ' ' ARG . 9.3 ttt180 -52.48 -26.61 13.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.777 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.29 -41.61 66.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.503 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.04 -43.07 88.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.116 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.588 ' HE3' ' HB2' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -68.98 -36.27 77.67 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.786 0.327 . . . . 0.0 110.387 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.534 ' HG2' ' HE2' ' A' ' 89' ' ' MET . 4.9 mm-40 -63.62 -31.38 72.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.078 0.466 . . . . 0.0 109.976 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -65.59 -39.1 91.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.85 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.583 HD12 ' HB1' ' A' ' 104' ' ' ALA . 29.4 mt -70.94 -40.23 72.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.562 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.444 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -55.79 -22.34 23.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.937 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -92.26 -23.43 19.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.978 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 71.5 p -121.64 39.01 3.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.822 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.404 ' CA ' ' HD3' ' A' ' 101' ' ' ARG . . . -38.42 104.67 0.03 OUTLIER Glycine 0 C--N 1.332 0.353 0 CA-C-N 115.761 -0.654 . . . . 0.0 113.611 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.2 p -144.8 132.18 20.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.838 0.351 . . . . 0.0 110.927 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.69 -143.58 46.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.477 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.405 ' HE1' ' HB3' ' A' ' 74' ' ' ALA . 10.6 p90 -84.16 -24.29 30.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.698 0.285 . . . . 0.0 110.819 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.5 ' HB3' HD11 ' A' ' 92' ' ' LEU . . . -44.9 -36.8 3.51 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.47 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.444 ' NE ' ' HA ' ' A' ' 93' ' ' ALA . 14.1 tpt180 -64.3 -61.88 1.96 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -54.46 -33.37 59.51 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.201 0.524 . . . . 0.0 110.261 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 43.3 t -65.19 -44.7 95.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.075 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.583 ' HB1' HD12 ' A' ' 92' ' ' LEU . . . -64.99 -59.02 4.63 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 61.1 t -55.15 -62.68 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.612 -178.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -55.46 -38.21 68.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.723 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.463 ' HH ' ' HA2' ' A' ' 81' ' ' GLY . 9.5 t80 -58.82 -44.66 90.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.906 0.384 . . . . 0.0 111.644 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.588 ' HB2' ' HE3' ' A' ' 89' ' ' MET . 0.2 OUTLIER -51.1 -17.74 0.7 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.026 -178.522 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -61.11 -8.94 3.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 111.004 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 56.1 p -122.29 -41.8 2.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.179 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 71.6 m80 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.809 -179.947 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.423 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.675 0.274 . . . . 0.0 111.703 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.474 ' HZ ' ' HB3' ' A' ' 54' ' ' ALA . 2.5 t80 -60.63 -46.54 89.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.508 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -54.08 47.0 Favored Pre-proline 0 N--CA 1.466 0.329 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.423 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 53.0 Cg_exo -46.32 -23.88 2.28 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.902 1.735 . . . . 0.0 111.011 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.549 HD21 HG13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -83.96 -46.83 11.65 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 114.322 -1.308 . . . . 0.0 110.128 179.667 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 31' ' ' LEU . 15.1 tp -69.13 -16.93 63.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.363 179.147 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -75.61 -36.57 60.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.771 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.4 m -66.34 -20.28 66.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.825 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 28' ' ' LEU . 91.2 mt -65.86 -9.52 29.82 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.574 0.226 . . . . 0.0 111.542 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.5 m -101.5 11.69 38.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.079 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -71.47 148.04 47.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.018 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.43 -18.28 65.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.965 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -86.76 162.48 17.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.791 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -102.86 -39.62 6.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.798 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -58.74 -37.5 76.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.894 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.2 mm -61.59 -41.57 90.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.717 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 76.4 mtt180 -62.45 -24.5 67.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.398 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.62 -64.36 3.63 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.858 -0.686 . . . . 0.0 112.197 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.74 -33.8 36.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.781 0.324 . . . . 0.0 110.948 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.34 -55.46 15.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.583 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.62 -26.01 68.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.742 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.415 ' NE1' ' HA2' ' A' ' 72' ' ' GLY . 5.3 m95 -70.63 -32.82 70.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.135 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.528 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 41.4 mt -99.46 -22.88 4.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.945 0.403 . . . . 0.0 111.41 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.549 HG13 HD21 ' A' ' 27' ' ' LEU . 4.4 tt -61.02 -37.56 77.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.19 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -78.08 -14.8 81.9 Favored Glycine 0 C--N 1.33 0.216 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.221 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.528 ' ND2' ' HA ' ' A' ' 45' ' ' ILE . 51.0 m-20 -70.74 -14.76 62.56 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -93.76 -10.31 34.67 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.421 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.7 OUTLIER 50.51 61.54 3.16 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.815 0.341 . . . . 0.0 111.412 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -127.93 161.68 28.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.164 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.69 -36.15 82.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.723 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -65.71 -9.06 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.046 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.474 ' HB3' ' HZ ' ' A' ' 24' ' ' PHE . . . -102.99 -13.67 16.79 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.866 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 41.7 t -72.15 -38.87 64.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.439 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.484 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 26.4 tt0 -57.07 -51.51 81.15 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.624 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.484 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 89.6 Cg_exo -41.97 -51.64 4.5 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.261 1.974 . . . . 0.0 112.156 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.445 HD23 ' HG ' ' A' ' 77' ' ' LEU . 8.4 mp -52.69 -37.5 59.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.961 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.2 mm -56.58 -61.44 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -72.4 -10.41 59.76 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.472 HD12 ' O ' ' A' ' 57' ' ' PRO . 1.8 mp -89.37 -49.39 6.73 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.413 HD22 HD22 ' A' ' 92' ' ' LEU . 11.4 mt -56.45 -15.52 4.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.851 0.358 . . . . 0.0 111.181 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -113.71 -11.82 12.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.454 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.7 OUTLIER -61.08 -46.09 92.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.056 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.584 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 14.4 t70 63.08 24.45 14.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.152 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.44 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.6 m -86.2 7.58 24.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.012 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.89 -108.47 3.52 Favored Glycine 0 C--O 1.229 -0.204 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.425 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -48.81 -30.9 6.25 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.257 0.551 . . . . 0.0 109.634 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.44 ' HB ' ' HB2' ' A' ' 66' ' ' SER . 58.8 t -72.08 -50.81 34.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.783 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.584 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 38.3 ttp180 -68.2 -62.45 1.39 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.108 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.5 m -51.04 -27.67 8.52 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.957 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.415 ' HA2' ' NE1' ' A' ' 44' ' ' TRP . . . -57.84 -56.2 26.44 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.73 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.439 ' CB ' ' HA ' ' A' ' 58' ' ' LEU . . . -56.2 -46.15 79.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.854 0.359 . . . . 0.0 110.907 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.12 -27.18 63.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.775 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.417 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 27.3 ttt-85 -83.8 -34.6 24.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.814 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.415 ' HA ' HE21 ' A' ' 79' ' ' GLN . 47.5 m -61.98 -39.47 92.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.621 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.445 ' HG ' HD23 ' A' ' 58' ' ' LEU . 1.1 mt -59.25 -59.24 5.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.717 0.294 . . . . 0.0 111.411 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -48.93 -38.86 24.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.706 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 41.4 mt-30 -70.81 -47.79 57.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.628 0.251 . . . . 0.0 111.37 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.531 HG23 ' HB ' ' A' ' 85' ' ' VAL . 90.0 mt -61.43 -60.63 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.36 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 53.88 70.55 0.9 Allowed Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.579 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -152.45 164.71 30.7 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.552 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -65.17 -27.64 68.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.848 0.356 . . . . 0.0 110.859 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.489 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -69.28 -50.99 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.875 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.531 ' HB ' HG23 ' A' ' 80' ' ' ILE . 9.9 p -70.77 -23.87 24.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.272 0.558 . . . . 0.0 110.331 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -53.46 -29.99 38.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.806 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.403 ' O ' ' HG2' ' A' ' 91' ' ' LYS . . . -65.87 -31.41 72.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.267 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.07 -51.38 69.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.968 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.432 ' SD ' ' N ' ' A' ' 90' ' ' GLU . 3.4 ppp? -69.72 -24.87 63.63 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.822 0.344 . . . . 0.0 110.387 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.432 ' N ' ' SD ' ' A' ' 89' ' ' MET . 28.2 mt-10 -68.17 -40.16 82.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.967 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 46.4 mmtm -78.78 -21.71 47.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.119 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 100' ' ' ALA . 0.3 OUTLIER -86.69 -30.33 21.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.786 0.327 . . . . 0.0 110.207 179.779 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.19 -26.81 67.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.975 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -80.11 -25.64 39.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.083 0.468 . . . . 0.0 110.288 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.2 p -117.4 24.42 11.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.349 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.493 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -58.24 121.68 27.04 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.153 -179.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 92.3 m -139.69 130.42 25.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.57 -0.315 . . . . 0.0 110.76 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.32 -133.8 52.6 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.759 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -66.41 -33.78 76.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.787 0.327 . . . . 0.0 111.146 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.454 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -51.28 -38.69 54.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.014 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.493 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 39.9 ttt180 -70.44 -60.02 2.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.811 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -46.57 -25.2 0.65 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.155 0.503 . . . . 0.0 110.749 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.413 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 37.1 t -67.7 -60.52 2.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.259 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.425 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -50.36 -59.65 3.77 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.5 t -58.4 -64.27 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -55.56 -38.34 69.21 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -58.84 -48.19 82.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.867 0.365 . . . . 0.0 111.445 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.425 ' HB3' ' HE2' ' A' ' 89' ' ' MET . 0.1 OUTLIER -53.61 -21.48 6.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.807 -178.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -54.98 -21.3 11.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.864 0.364 . . . . 0.0 110.992 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.9 p -95.25 -49.11 5.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.146 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 73.4 m80 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.865 -179.98 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 -0.076 0 CA-C-O 120.824 0.345 . . . . 0.0 110.938 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.561 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -57.21 -50.83 71.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.702 -179.422 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.478 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.38 -55.71 33.25 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.634 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 87.6 Cg_exo -45.56 -27.81 3.8 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 122.093 1.862 . . . . 0.0 111.438 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.561 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 47.5 mt -71.17 -50.16 36.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.845 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.537 HD13 HD11 ' A' ' 31' ' ' LEU . 10.4 tp -73.08 -18.41 61.31 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.448 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -81.53 -39.52 24.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.389 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.5 t -66.39 -10.83 47.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.729 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.537 HD11 HD13 ' A' ' 28' ' ' LEU . 58.4 mt -63.51 -21.08 66.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.711 0.291 . . . . 0.0 111.116 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.9 p -104.52 8.77 35.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.844 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -64.65 150.37 47.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.149 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -67.86 -44.43 77.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.829 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -77.73 133.52 38.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.003 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.1 m0 -79.71 -22.44 43.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.675 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -61.99 -48.31 80.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.47 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.6 mt -75.46 -37.61 38.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.666 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.52 ' HG2' ' HA ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -61.64 -32.65 72.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.225 179.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.44 -57.38 7.47 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.307 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.21 -29.18 1.48 Allowed 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 120.798 0.332 . . . . 0.0 111.287 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.67 -54.85 42.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.366 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.79 -29.29 70.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.673 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -65.29 -34.41 78.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.242 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.427 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 29.1 mt -101.05 -20.82 5.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.855 0.359 . . . . 0.0 111.599 -179.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.445 HD11 ' HG2' ' A' ' 57' ' ' PRO . 1.3 tt -60.42 -36.89 72.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.84 -8.23 72.32 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.244 -0.979 . . . . 0.0 112.703 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.631 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.7 OUTLIER -70.78 -22.75 62.34 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.568 0.21 . . . . 0.0 111.568 -179.503 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -88.24 -32.86 18.32 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.722 0.268 . . . . 0.0 111.722 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.583 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 36.3 mt-30 66.22 19.04 11.06 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.593 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -86.11 169.41 13.15 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.759 0.314 . . . . 0.0 110.804 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.67 -36.82 85.52 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.613 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 32.0 ttm180 -68.05 -9.88 49.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.815 0.34 . . . . 0.0 111.066 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -104.15 4.54 34.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.165 0.507 . . . . 0.0 110.41 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.3 t -91.12 -33.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.7 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.54 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.4 tm-20 -60.21 -50.24 86.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.766 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.54 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 82.4 Cg_exo -46.86 -49.4 12.46 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.304 2.003 . . . . 0.0 112.471 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.516 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . 6.6 mt -58.84 -28.25 65.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.716 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.8 mm -63.38 -61.3 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 64' ' ' ASP . 21.8 ttpt -72.02 -39.17 69.36 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.48 ' HG ' HG11 ' A' ' 69' ' ' VAL . 2.4 mp -55.54 -51.32 67.46 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -178.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.548 HD12 HD22 ' A' ' 77' ' ' LEU . 49.9 mt -62.19 -10.19 9.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.109 0.48 . . . . 0.0 110.358 -179.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -113.91 -15.06 12.41 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.025 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' A' ' 60' ' ' LYS . 10.3 t0 -61.09 -47.72 84.98 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.383 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.515 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 5.7 m-20 62.55 28.15 16.57 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.458 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.441 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 48.1 t -84.8 -16.99 39.58 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 111.089 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 113.98 -104.82 1.5 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.026 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.16 -28.26 10.63 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.46 0.648 . . . . 0.0 109.301 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.48 HG11 ' HG ' ' A' ' 61' ' ' LEU . 17.8 t -73.67 -54.99 13.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.812 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.515 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 32.7 ttp180 -66.94 -61.52 1.9 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.047 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.0 t -52.06 -31.56 30.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.933 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.34 -35.33 90.8 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.321 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.516 ' HB3' ' HA ' ' A' ' 58' ' ' LEU . . . -84.68 -23.43 29.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.741 0.305 . . . . 0.0 111.045 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.51 -52.87 63.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.153 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.508 HH21 ' HB2' ' A' ' 76' ' ' SER . 0.0 OUTLIER -79.44 -17.28 54.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.012 179.847 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.514 ' HG ' HD23 ' A' ' 58' ' ' LEU . 48.3 t -63.48 -45.94 88.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.886 0.374 . . . . 0.0 110.497 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.609 HD11 ' HE2' ' A' ' 89' ' ' MET . 0.4 OUTLIER -56.84 -57.44 12.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.227 179.56 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -55.21 -34.45 63.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.53 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.508 ' NE2' HH22 ' A' ' 75' ' ' ARG . 10.7 tt0 -68.73 -23.78 64.39 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.964 0.412 . . . . 0.0 110.16 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.583 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 57.2 mt -81.95 -61.02 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.447 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 56.6 92.82 0.01 OUTLIER Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.718 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 173.26 172.13 38.51 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.595 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -63.69 -26.45 68.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.834 0.35 . . . . 0.0 110.948 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.485 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -61.78 -57.46 11.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.826 -179.684 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.472 ' H ' ' HG2' ' A' ' 84' ' ' ARG . 9.9 p -70.68 -23.7 24.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.648 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 3.2 tmt_? -51.35 -33.46 29.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.375 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.18 -32.46 56.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.642 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.14 -36.5 73.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.748 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.609 ' HE2' HD11 ' A' ' 77' ' ' LEU . 1.6 mmm -69.8 -53.47 18.1 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.317 -0.401 . . . . 0.0 109.93 179.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -54.22 -29.13 45.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.298 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -76.87 -32.08 57.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.55 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.586 HD22 ' HB2' ' A' ' 104' ' ' ALA . 1.3 tp -86.74 -29.44 22.37 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.936 0.398 . . . . 0.0 110.427 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.25 -31.77 65.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.887 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -80.16 -24.71 40.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.319 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.7 p -118.35 33.09 5.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.555 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.427 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -48.23 124.79 11.68 Favored Glycine 0 N--CA 1.449 -0.44 0 CA-C-N 114.951 -1.022 . . . . 0.0 114.085 -178.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 20.2 m -143.33 130.31 20.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.493 -0.354 . . . . 0.0 110.162 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 65.74 -142.41 43.65 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.347 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -81.6 -22.23 37.83 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.709 0.29 . . . . 0.0 110.933 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.498 ' HB3' ' HB3' ' A' ' 62' ' ' LEU . . . -49.92 -41.08 45.28 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.909 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.427 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 61.6 ttt180 -56.14 -60.88 2.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.739 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -54.69 -25.92 30.25 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.562 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.6 t -72.4 -50.83 32.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.742 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.586 ' HB2' HD22 ' A' ' 92' ' ' LEU . . . -53.26 -55.53 23.76 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.8 t -60.81 -61.78 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.724 -178.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.402 ' HA ' ' OE2' ' A' ' 109' ' ' GLU . 13.1 m120 -56.35 -36.33 68.65 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -61.91 -30.74 71.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.963 0.411 . . . . 0.0 111.232 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.5 mt -56.27 -15.95 4.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.977 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.402 ' OE2' ' HA ' ' A' ' 106' ' ' ASN . 0.5 OUTLIER -75.23 1.21 14.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.434 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 61.4 p -111.81 -61.6 1.68 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.742 0.306 . . . . 0.0 111.023 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.814 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 120.974 0.416 . . . . 0.0 110.416 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.469 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 4.6 t80 -57.85 -60.19 4.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.406 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.519 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -63.51 -53.32 52.84 Favored Pre-proline 0 N--CA 1.466 0.328 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.863 -178.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.537 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 9.7 Cg_endo -51.56 -25.41 19.47 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 121.777 1.652 . . . . 0.0 110.513 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.541 HD23 HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -75.77 -40.59 55.0 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.128 178.064 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.597 HD23 ' HD3' ' A' ' 53' ' ' ARG . 6.1 tp -73.84 -20.46 60.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.137 177.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 25' ' ' GLU . 3.2 tm-20 -77.69 -40.97 39.66 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.599 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.7 m -61.76 -19.55 62.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.263 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.495 HD12 HD11 ' A' ' 28' ' ' LEU . 79.1 mt -66.85 -9.35 36.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.729 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.0 t -109.6 18.9 19.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.872 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -85.36 135.12 34.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.939 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -58.56 -25.51 62.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.786 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -83.67 153.69 24.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.729 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -104.89 -25.88 12.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -63.01 -36.59 84.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.867 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.5 mt -81.19 -36.94 15.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.8 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -63.91 -31.84 73.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -56.6 -57.08 21.29 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.354 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.34 -38.82 59.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.691 0.281 . . . . 0.0 110.977 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.43 -50.62 71.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.383 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.429 ' HB2' HD23 ' A' ' 61' ' ' LEU . . . -65.24 -35.29 80.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.745 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.4 m95 -66.1 -32.13 73.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.926 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.453 ' HA ' HD21 ' A' ' 48' ' ' ASN . 38.7 mm -99.41 -23.14 4.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.541 HD11 HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -54.52 -37.82 39.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -178.536 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -67.68 -19.51 71.25 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.867 -0.682 . . . . 0.0 113.769 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.453 HD21 ' HA ' ' A' ' 45' ' ' ILE . 42.1 m-80 -70.69 -0.89 9.72 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -101.64 -26.26 13.58 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.495 ' HG2' HG23 ' A' ' 80' ' ' ILE . 19.6 mt-30 62.11 18.3 9.9 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -93.43 167.84 11.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.614 0.245 . . . . 0.0 110.692 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -62.32 -31.8 72.47 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.812 0.339 . . . . 0.0 110.684 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.597 ' HD3' HD23 ' A' ' 28' ' ' LEU . 34.4 ttm180 -69.2 -9.52 53.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.011 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.421 ' CB ' HD12 ' A' ' 46' ' ' ILE . . . -100.24 -7.54 24.54 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.207 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.4 t -91.14 -39.18 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.577 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.531 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 21.5 tt0 -60.51 -50.85 83.7 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 89.1 Cg_exo -47.8 -45.73 23.43 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.11 1.874 . . . . 0.0 112.029 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.537 HD21 ' HA ' ' A' ' 73' ' ' ALA . 4.6 mt -57.95 -31.47 66.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.639 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.405 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 50.9 mm -57.41 -61.54 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -11.75 60.79 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.605 ' HG ' HG13 ' A' ' 69' ' ' VAL . 1.3 mp -84.85 -49.63 8.24 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.513 HD23 HD22 ' A' ' 92' ' ' LEU . 8.8 mt -59.4 -10.05 2.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.17 0.51 . . . . 0.0 110.289 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 59' ' ' ILE . 8.2 pt-20 -115.42 -17.22 11.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.18 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -61.07 -32.81 72.45 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.151 0.501 . . . . 0.0 110.943 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.613 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 1.5 m-20 50.4 30.08 4.33 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.722 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.467 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 47.5 t -85.94 2.41 46.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.776 0.322 . . . . 0.0 111.094 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.28 -89.13 1.6 Allowed Glycine 0 C--O 1.228 -0.244 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.694 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -58.76 -38.55 78.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.932 0.396 . . . . 0.0 110.224 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.605 HG13 ' HG ' ' A' ' 61' ' ' LEU . 14.3 t -73.77 -49.23 36.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.233 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.613 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 45.9 ttp180 -62.48 -58.3 8.12 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.927 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 33.4 t -51.96 -26.76 11.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.771 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -60.12 -39.77 96.27 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.542 -0.837 . . . . 0.0 111.544 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.537 ' HA ' HD21 ' A' ' 58' ' ' LEU . . . -71.26 -49.96 37.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.847 0.356 . . . . 0.0 110.42 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.97 -25.69 58.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.274 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -84.16 -32.46 24.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.502 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.488 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 66.9 m -67.08 -44.78 79.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.008 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.577 ' HA ' HG21 ' A' ' 85' ' ' VAL . 2.5 mp -55.67 -59.64 4.56 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.513 -179.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -49.28 -36.14 19.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.714 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.488 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 19.9 mt-30 -66.07 -57.87 6.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.812 0.339 . . . . 0.0 111.186 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.495 HG23 ' HG2' ' A' ' 50' ' ' GLN . 92.0 mt -53.92 -60.34 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.412 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 59.73 88.45 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.41 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 175.12 172.46 40.06 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.48 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -65.91 -22.48 66.51 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.747 0.308 . . . . 0.0 111.267 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.486 ' HG2' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -63.37 -62.84 1.41 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.472 -179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.577 HG21 ' HA ' ' A' ' 77' ' ' LEU . 3.4 p -70.85 -21.18 22.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.728 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -50.66 -46.38 58.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.376 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.32 -24.0 26.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.061 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.46 -42.55 68.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.402 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.577 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -71.88 -30.82 65.8 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.446 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.429 ' HG2' ' HE3' ' A' ' 89' ' ' MET . 47.1 mt-10 -66.7 -39.27 88.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.649 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -77.57 -23.0 50.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.131 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.513 HD22 HD23 ' A' ' 62' ' ' LEU . 1.2 tp -85.99 -26.98 25.14 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.34 -24.09 66.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.412 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -80.29 -26.49 38.88 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.411 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 64.3 p -117.01 20.23 13.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.556 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.505 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -53.7 121.74 19.35 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 115.095 -0.957 . . . . 0.0 113.27 -179.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.8 m -142.67 130.13 21.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.79 0.328 . . . . 0.0 110.835 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 57.84 -129.34 49.39 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.845 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.423 ' O ' HG23 ' A' ' 103' ' ' VAL . 57.2 t80 -70.25 -35.04 73.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.727 0.299 . . . . 0.0 111.204 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.422 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -52.0 -35.96 48.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.049 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.505 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 45.4 ttt180 -72.21 -57.27 4.38 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -48.28 -21.99 0.6 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.122 0.487 . . . . 0.0 110.762 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 99' ' ' PHE . 32.4 t -68.35 -60.4 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.645 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.577 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -54.75 -54.75 37.9 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.282 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.489 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 57.4 t -59.02 -61.38 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.586 -178.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -56.1 -37.92 70.05 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -58.73 -29.19 66.51 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.489 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -51.51 -28.96 14.97 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -75.22 6.78 3.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.662 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.5 m -100.22 -61.13 1.41 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.685 0.279 . . . . 0.0 111.465 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.94 -179.749 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.503 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.23 0.064 0 CA-C-O 121.148 0.499 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.535 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.0 t80 -61.76 -40.9 96.76 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.306 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.31 -55.56 34.97 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.469 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.503 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 65.9 Cg_exo -38.16 -29.57 0.14 Allowed 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 122.655 2.237 . . . . 0.0 112.124 178.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.535 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 28.4 mt -66.46 -58.67 4.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.39 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.586 HD13 HD11 ' A' ' 31' ' ' LEU . 24.3 tp -66.74 -20.18 65.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.201 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -79.35 -34.64 41.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.849 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.493 ' HB3' HG22 ' A' ' 38' ' ' ILE . 75.6 m -65.77 -24.68 66.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.46 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.586 HD11 HD13 ' A' ' 28' ' ' LEU . 82.5 mt -61.63 -12.06 14.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.791 0.329 . . . . 0.0 110.988 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.5 m -91.13 20.32 5.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.135 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -103.91 138.94 39.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.901 0.381 . . . . 0.0 111.258 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -67.75 -15.53 63.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.679 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -76.12 152.18 36.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.107 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 15.5 m0 -95.7 -36.14 11.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.095 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -58.85 -38.2 78.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.187 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.493 HG22 ' HB3' ' A' ' 30' ' ' SER . 41.0 mt -75.11 -34.52 31.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.721 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.4 ' HD2' HD12 ' A' ' 61' ' ' LEU . 7.1 mmt180 -60.7 -55.85 28.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.276 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.3 -57.12 21.52 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.954 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.73 -36.24 4.87 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.766 0.317 . . . . 0.0 111.509 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.464 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.77 -53.33 57.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.044 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.32 -25.77 63.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.606 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.403 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 7.1 m95 -60.36 -42.54 95.98 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.681 0.622 . . . . 0.0 112.681 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.6 mm -99.35 -23.59 4.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.6 HD11 ' HG2' ' A' ' 57' ' ' PRO . 5.6 tt -59.87 -33.95 54.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -178.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.58 -27.13 69.21 Favored Glycine 0 CA--C 1.518 0.22 0 C-N-CA 120.707 -0.759 . . . . 0.0 113.254 -179.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -70.73 0.72 6.47 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -94.67 -27.41 15.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.627 ' HG3' ' HA ' ' A' ' 80' ' ' ILE . 14.9 mp0 62.35 26.04 15.55 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.234 0.54 . . . . 0.0 110.778 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -102.57 166.31 10.59 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.121 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -65.56 -34.83 79.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.16 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.498 ' HG3' HD23 ' A' ' 28' ' ' LEU . 34.2 ttm180 -67.34 -10.02 46.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.56 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -104.82 0.36 28.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.633 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.4 t -90.69 -50.16 13.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.541 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.536 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.3 tm-20 -58.62 -49.38 93.77 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.958 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.6 ' HG2' HD11 ' A' ' 46' ' ' ILE . 72.8 Cg_exo -49.83 -27.44 15.75 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.32 2.013 . . . . 0.0 112.762 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.529 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . 23.4 mt -74.23 -54.1 8.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.097 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.447 ' HA ' HD12 ' A' ' 62' ' ' LEU . 44.7 mm -49.66 -48.21 20.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.875 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -70.02 -30.16 67.4 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 -179.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.57 ' HG ' HG13 ' A' ' 69' ' ' VAL . 4.1 tp -89.82 -17.99 27.09 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.54 HD11 HD22 ' A' ' 92' ' ' LEU . 14.1 mt -70.43 -14.38 62.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.016 0.436 . . . . 0.0 110.828 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -115.12 6.75 15.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.03 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -61.11 -32.21 71.9 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.244 0.545 . . . . 0.0 110.841 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.507 ' HB2' HH21 ' A' ' 70' ' ' ARG . 18.8 t70 55.32 23.72 5.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.066 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.504 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 31.0 t -86.29 -26.01 25.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.84 0.353 . . . . 0.0 110.693 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 125.34 -109.36 1.18 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.485 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.403 ' HD1' ' NE1' ' A' ' 44' ' ' TRP . 0.1 OUTLIER -56.93 -24.33 51.72 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.253 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.57 HG13 ' HG ' ' A' ' 61' ' ' LEU . 39.9 t -68.59 -36.53 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.798 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.507 HH21 ' HB2' ' A' ' 65' ' ' ASP . 19.5 ttm180 -78.45 -51.17 10.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.726 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.1 m -58.02 -37.7 74.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.078 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.09 -51.34 50.87 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.224 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.529 ' HB3' ' HA ' ' A' ' 58' ' ' LEU . . . -67.34 -34.02 76.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.934 0.397 . . . . 0.0 110.703 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.529 ' HA ' HD23 ' A' ' 62' ' ' LEU . . . -55.48 -61.58 2.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.952 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -57.17 -27.71 62.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.019 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.421 ' O ' HG13 ' A' ' 80' ' ' ILE . 49.0 m -61.63 -29.92 70.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.76 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.491 HD12 HD13 ' A' ' 62' ' ' LEU . 8.3 mp -55.57 -61.34 2.41 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.711 0.291 . . . . 0.0 111.517 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.423 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 6.1 pt-20 -61.31 -24.99 66.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.997 0.427 . . . . 0.0 110.558 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -70.67 -23.95 62.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.234 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.627 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 91.6 mt -81.83 -60.38 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.543 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . 174.93 -130.94 1.85 Allowed Glycine 0 C--N 1.334 0.433 0 C-N-CA 119.962 -1.113 . . . . 0.0 113.805 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.461 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . -140.89 -72.89 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.768 -0.729 . . . . 0.0 113.623 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -60.9 -25.5 66.78 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.545 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -86.2 -50.71 6.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.675 0.274 . . . . 0.0 111.038 -179.361 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.545 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -70.84 -20.86 22.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.474 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -49.57 -30.4 8.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.522 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.42 -32.23 54.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.144 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.14 -51.48 37.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.941 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.56 ' HE2' ' HB3' ' A' ' 104' ' ' ALA . 4.1 ppp? -64.19 -25.68 68.18 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.548 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -70.21 -37.83 75.14 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -69.7 -28.91 66.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.476 179.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.54 HD22 HD11 ' A' ' 62' ' ' LEU . 1.4 tp -87.57 -27.53 22.51 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.961 0.41 . . . . 0.0 110.123 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.17 -30.97 71.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.253 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.454 ' HG3' HG22 ' A' ' 95' ' ' THR . 12.1 pt-20 -80.22 -22.99 41.21 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 121.088 0.47 . . . . 0.0 109.758 179.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.454 HG22 ' HG3' ' A' ' 94' ' ' GLU . 52.3 p -108.9 13.16 24.98 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.506 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.79 113.94 4.41 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 114.957 -1.019 . . . . 0.0 113.028 -179.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 39.4 m -140.31 130.09 24.48 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.474 -0.363 . . . . 0.0 110.868 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.69 -126.65 42.56 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.638 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -73.52 -34.23 65.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.674 0.273 . . . . 0.0 111.263 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.436 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.63 -33.27 54.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.983 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.506 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 29.7 ttt180 -72.39 -56.07 6.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.365 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -48.72 -22.94 0.88 Allowed 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.182 0.515 . . . . 0.0 110.602 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.436 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 33.0 t -67.07 -55.04 19.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.646 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.56 ' HB3' ' HE2' ' A' ' 89' ' ' MET . . . -61.97 -57.07 13.11 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.42 HG13 ' H ' ' A' ' 106' ' ' ASN . 5.2 p -59.65 -58.65 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.42 ' H ' HG13 ' A' ' 105' ' ' VAL . 4.8 t30 -56.72 -30.12 63.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.709 0.29 . . . . 0.0 111.31 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.496 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 1.2 t80 -58.96 -35.18 72.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.128 0.489 . . . . 0.0 110.308 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.411 ' HG ' ' HE1' ' A' ' 89' ' ' MET . 91.8 mt -53.05 -14.37 0.6 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.898 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.01 6.23 11.95 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.7 p -121.59 -63.49 1.31 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.667 0.27 . . . . 0.0 111.506 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 23.6 p80 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 117.946 -1.026 . . . . 0.0 111.573 -179.784 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.846 0.355 . . . . 0.0 111.415 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.468 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 2.3 t80 -63.42 -45.19 92.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.153 0.501 . . . . 0.0 110.817 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.463 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 7.2 mm-40 -63.41 -56.04 30.34 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.536 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.2 Cg_endo -55.6 -14.52 10.26 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 121.712 1.608 . . . . 0.0 110.643 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.531 HD23 HG13 ' A' ' 46' ' ' ILE . 1.4 tp -86.47 -40.26 15.48 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.373 -1.285 . . . . 0.0 109.212 178.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.576 HD11 HD11 ' A' ' 31' ' ' LEU . 31.8 tp -75.15 -22.49 58.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.297 179.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -69.0 -29.68 67.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.612 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 63.8 m -65.09 -27.71 68.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.41 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.682 ' HB3' ' HZ2' ' A' ' 60' ' ' LYS . 40.7 mt -65.78 -11.35 45.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.172 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.0 m -100.68 16.38 25.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.645 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -88.93 145.51 25.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -67.79 -27.77 67.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.866 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -75.84 146.21 40.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.933 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 12.2 p90 -87.38 -32.91 19.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.2 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.95 -32.12 73.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.923 0.392 . . . . 0.0 110.37 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.9 mm -81.32 -41.01 18.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.294 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.447 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 40.9 ttm180 -64.06 -48.34 76.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.58 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -57.95 -49.55 73.83 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.791 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.09 -26.98 12.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.642 0.258 . . . . 0.0 111.46 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.427 ' O ' HD12 ' A' ' 27' ' ' LEU . . . -62.82 -56.69 15.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.71 0.29 . . . . 0.0 111.049 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.414 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -65.81 -28.84 69.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.049 0.452 . . . . 0.0 110.777 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.2 m95 -57.01 -39.49 74.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.481 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.8 mt -98.35 -25.73 3.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.772 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.531 HG13 HD23 ' A' ' 27' ' ' LEU . 3.5 tt -57.93 -20.99 15.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.361 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.86 -27.56 64.49 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.692 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.545 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.9 OUTLIER -60.29 -30.46 69.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.715 0.293 . . . . 0.0 111.018 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -104.69 106.01 16.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.509 ' HG2' HG21 ' A' ' 80' ' ' ILE . 2.5 mt-30 -66.93 80.0 0.12 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.08 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -128.18 156.72 42.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.006 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.41 -28.58 69.35 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.927 0.394 . . . . 0.0 110.989 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -69.31 -9.52 53.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.757 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.5 ' HB1' HG12 ' A' ' 46' ' ' ILE . . . -104.85 15.4 27.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.62 -179.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 56.5 t -91.55 -58.1 3.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.118 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.465 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 17.5 tt0 -56.49 -48.87 96.29 Favored Pre-proline 0 CA--C 1.531 0.216 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.515 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 86.0 Cg_exo -42.12 -48.1 6.54 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.396 2.064 . . . . 0.0 112.527 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.533 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . 7.5 mt -62.13 -44.7 96.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.065 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 50.0 mm -53.66 -58.89 2.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.192 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.682 ' HZ2' ' HB3' ' A' ' 31' ' ' LEU . 3.7 pttt -70.16 -18.93 63.22 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.634 ' HG ' HG13 ' A' ' 69' ' ' VAL . 2.9 tp -89.52 -32.71 17.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.688 HD12 HD13 ' A' ' 92' ' ' LEU . 14.2 mt -64.82 -10.49 28.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.127 0.489 . . . . 0.0 110.381 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -114.26 -2.18 13.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.113 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -61.21 -30.23 70.3 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.134 0.493 . . . . 0.0 111.055 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 54.39 27.15 7.77 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.913 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.487 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.4 t -85.0 -19.36 32.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.943 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 119.86 -110.25 1.78 Allowed Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.48 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -56.92 -26.28 58.95 Favored 'General case' 0 CA--C 1.521 -0.155 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.634 HG13 ' HG ' ' A' ' 61' ' ' LEU . 15.5 t -68.24 -34.11 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.879 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -78.44 -40.85 34.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.838 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 97.3 p -67.03 -38.88 86.7 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.478 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.438 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -53.33 -55.23 25.61 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.6 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.533 ' HB3' ' HA ' ' A' ' 58' ' ' LEU . . . -55.72 -32.72 63.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.786 0.327 . . . . 0.0 111.457 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.427 ' HA ' HD23 ' A' ' 62' ' ' LEU . . . -61.78 -63.89 1.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.581 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 72' ' ' GLY . 0.3 OUTLIER -53.62 -32.64 52.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.341 -179.843 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.428 ' HA ' HE21 ' A' ' 79' ' ' GLN . 17.9 t -56.2 -40.28 73.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 110.865 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.552 HD12 HD11 ' A' ' 62' ' ' LEU . 20.0 mt -62.76 -58.52 7.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -50.4 -35.62 29.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.732 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.428 HE21 ' HA ' ' A' ' 76' ' ' SER . 46.3 mt-30 -62.67 -37.35 86.08 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.068 0.461 . . . . 0.0 110.148 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.509 HG21 ' HG2' ' A' ' 50' ' ' GLN . 95.1 mt -72.8 -60.27 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.792 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 59.49 98.88 0.01 OUTLIER Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.803 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.5 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 172.99 -169.73 42.88 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.617 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -72.03 -30.27 65.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.93 0.395 . . . . 0.0 110.777 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.557 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -59.51 -50.47 73.77 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.004 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.557 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 16.5 m -70.74 -25.35 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.002 0.429 . . . . 0.0 110.739 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.42 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -55.77 -27.92 53.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.466 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.22 -34.64 32.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.755 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.08 -49.47 76.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.891 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.536 ' HB3' ' HA ' ' A' ' 104' ' ' ALA . 3.2 mmm -60.17 -46.79 88.5 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -53.3 -32.56 49.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.071 178.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -73.67 -31.37 63.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.848 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.688 HD13 HD12 ' A' ' 62' ' ' LEU . 25.6 mt -76.53 -38.65 54.76 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.85 0.357 . . . . 0.0 110.606 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.448 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -53.21 -32.45 48.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.068 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -84.82 -19.98 31.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.695 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.8 p -122.41 38.37 4.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.55 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -41.94 117.36 1.26 Allowed Glycine 0 C--N 1.334 0.434 0 CA-C-N 115.741 -0.663 . . . . 0.0 113.353 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.4 t -157.45 136.31 11.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.822 0.344 . . . . 0.0 111.091 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.16 -144.96 46.79 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.417 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -91.81 -14.55 29.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.792 0.33 . . . . 0.0 110.457 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -53.99 -35.64 62.08 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.231 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.448 ' NE ' ' HA ' ' A' ' 93' ' ' ALA . 13.9 tpt180 -67.53 -55.8 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.095 179.078 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -48.53 -28.11 3.16 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.727 178.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.2 t -78.03 -44.51 27.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.805 -1.088 . . . . 0.0 111.343 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.536 ' HA ' ' HB3' ' A' ' 89' ' ' MET . . . -54.89 -57.92 9.68 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -178.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.435 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 42.2 t -61.06 -58.59 6.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.326 -178.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -56.51 -42.8 78.98 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.439 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 43.1 t80 -62.03 -28.33 69.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.811 0.339 . . . . 0.0 111.606 -178.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 46.5 mt -58.08 -11.87 2.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.627 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -80.21 4.97 15.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.75 0.309 . . . . 0.0 111.07 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.2 p -140.64 -69.97 0.39 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.207 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.007 -0.996 . . . . 0.0 111.567 179.876 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.497 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.692 0.282 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -50.07 -49.78 50.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.315 179.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.27 -52.55 60.57 Favored Pre-proline 0 N--CA 1.466 0.374 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.822 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.497 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 71.6 Cg_exo -35.03 -34.75 0.1 Allowed 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 122.453 2.102 . . . . 0.0 112.172 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.438 HD12 ' O ' ' A' ' 23' ' ' ALA . 8.4 mp -73.79 -55.3 6.4 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.01 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.503 HD13 HD13 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -50.36 -37.46 37.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.52 178.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -66.62 -32.62 74.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.86 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.7 m -64.92 -13.75 57.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.117 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.503 HD13 HD13 ' A' ' 28' ' ' LEU . 87.7 mt -68.72 -19.81 64.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.897 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 56.7 m -93.36 7.64 43.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.92 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -79.92 128.1 33.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.669 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -58.88 -23.51 61.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.613 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -75.85 149.19 37.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.778 0.323 . . . . 0.0 110.565 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 38.4 p-90 -94.43 -37.95 11.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.442 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -63.69 -42.27 98.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.788 0.328 . . . . 0.0 111.036 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.6 mt -67.56 -44.61 86.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.867 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.457 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.4 ttm180 -63.31 -23.48 67.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.576 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.33 -61.0 6.07 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.48 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.14 -36.31 8.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.733 0.301 . . . . 0.0 111.402 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.409 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.56 -54.71 39.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.906 0.384 . . . . 0.0 110.861 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.8 -30.5 71.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.327 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.3 m95 -70.8 -31.2 67.88 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 61.7 mt -99.6 -27.02 3.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.873 0.368 . . . . 0.0 111.648 -178.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.587 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.1 tt -60.85 -28.88 44.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.699 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.541 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -69.89 -4.06 46.13 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.937 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.479 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.9 OUTLIER -69.82 -40.22 76.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.755 0.312 . . . . 0.0 110.196 179.346 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.505 ' C ' ' H ' ' A' ' 51' ' ' ASP . 11.9 m-85 -91.33 119.42 31.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.738 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.42 ' HG2' HD13 ' A' ' 80' ' ' ILE . 1.9 mt-30 -72.78 25.85 0.06 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.48 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.505 ' H ' ' C ' ' A' ' 49' ' ' PHE . 29.2 t70 -83.98 155.33 22.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.908 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -59.07 -33.0 70.29 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.329 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -67.63 -11.96 59.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.865 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.464 ' O ' HD12 ' A' ' 58' ' ' LEU . . . -105.91 -8.45 17.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.036 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.435 ' O ' HG12 ' A' ' 59' ' ' ILE . 96.4 t -91.52 -30.16 4.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.418 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.545 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 17.3 tt0 -60.27 -50.52 85.57 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.587 ' HG2' HD13 ' A' ' 46' ' ' ILE . 74.5 Cg_exo -49.32 -52.37 8.91 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.924 1.75 . . . . 0.0 111.859 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.578 HD22 ' HG ' ' A' ' 77' ' ' LEU . 5.1 mp -56.04 -27.17 52.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.881 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.435 HG12 ' O ' ' A' ' 55' ' ' VAL . 40.4 mm -63.35 -59.54 4.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.739 0.304 . . . . 0.0 111.379 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -70.04 -22.79 63.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.521 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.599 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -65.37 -51.94 57.04 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.941 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.557 HD23 HD23 ' A' ' 92' ' ' LEU . 9.1 mt -51.93 -21.58 3.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.351 . . . . 0.0 111.304 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -104.24 -18.36 14.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.107 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -59.65 -36.06 75.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 111.144 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.479 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 24.7 t70 52.19 30.28 7.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.229 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.462 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.3 t -80.07 -3.07 47.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.217 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.87 -81.56 1.6 Allowed Glycine 0 C--O 1.228 -0.238 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.944 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.64 -47.15 82.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.2 0.524 . . . . 0.0 109.649 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.599 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.2 t -69.04 -45.44 80.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.46 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.479 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 7.0 tmm_? -64.32 -62.45 1.6 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.873 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.7 m -54.07 -30.14 47.01 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.975 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.72 -39.85 94.13 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.41 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.9 -38.85 83.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.638 0.256 . . . . 0.0 111.363 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.63 -54.23 24.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.3 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 75' ' ' ARG . 4.0 ptp180 -67.96 -42.94 80.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.002 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.541 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 74.6 m -59.21 -31.06 68.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.742 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.578 ' HG ' HD22 ' A' ' 58' ' ' LEU . 69.6 mt -70.67 -60.46 2.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.975 -179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -59.87 -22.51 62.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.147 0.499 . . . . 0.0 110.293 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 75' ' ' ARG . 7.6 tt0 -56.9 -37.49 71.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.56 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.42 HD13 ' HG2' ' A' ' 50' ' ' GLN . 32.2 mm -71.56 -60.22 2.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.963 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.446 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 69.45 80.31 0.26 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.296 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -176.69 179.1 47.85 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.391 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -63.44 -22.39 66.86 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.823 0.345 . . . . 0.0 110.971 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.491 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -62.07 -59.88 4.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.355 -179.598 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.551 HG12 HD22 ' A' ' 77' ' ' LEU . 74.8 t -69.64 -24.09 26.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.94 0.4 . . . . 0.0 110.638 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.425 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 2.7 tmt_? -56.65 -27.44 58.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.072 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -82.67 -31.8 28.46 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.769 0.319 . . . . 0.0 111.079 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.79 -34.51 75.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.422 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.544 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 7.0 mmt -71.17 -47.57 56.91 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.414 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -57.74 -29.85 65.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.031 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -80.07 -32.7 39.29 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.935 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.557 HD23 HD23 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -80.81 -26.08 37.37 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.022 0.439 . . . . 0.0 109.847 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.02 -21.67 65.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.526 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -80.22 -27.21 38.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.675 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.1 p -118.44 24.27 11.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.387 178.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.435 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -56.85 119.65 16.59 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.549 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.4 t -144.58 130.4 19.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.836 0.351 . . . . 0.0 110.894 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.44 -130.08 11.84 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.824 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -87.0 -26.51 23.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.571 0.225 . . . . 0.0 111.267 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.48 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.42 -37.49 62.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.859 0.362 . . . . 0.0 111.5 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.435 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 35.4 ttp180 -66.56 -58.46 5.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.707 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 57.9 tttp -46.23 -24.31 0.45 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.191 0.52 . . . . 0.0 110.79 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 45.2 t -71.93 -59.74 3.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.634 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.51 ' HA ' ' SD ' ' A' ' 89' ' ' MET . . . -56.34 -51.79 66.95 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 15.5 t -62.27 -63.74 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -55.36 -39.3 69.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.544 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 31.0 t80 -61.57 -31.73 71.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 120.808 0.337 . . . . 0.0 111.441 -178.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 58.5 mt -57.38 -12.19 2.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.61 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.86 -12.2 60.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.865 0.364 . . . . 0.0 110.993 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 73.0 p -113.7 -62.62 1.57 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.309 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.152 -0.927 . . . . 0.0 110.805 -179.971 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.51 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.458 -0.054 0 CA-C-O 120.605 0.24 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.551 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.4 t80 -60.61 -48.59 81.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.969 0.414 . . . . 0.0 110.243 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -63.45 -56.99 22.03 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.965 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.51 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 88.0 Cg_exo -43.04 -28.82 1.38 Allowed 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.365 2.043 . . . . 0.0 111.624 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.551 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 65.3 mt -68.76 -55.02 12.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.298 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.499 HD12 HD11 ' A' ' 31' ' ' LEU . 18.7 tp -67.88 -18.82 64.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.513 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -79.04 -42.8 25.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.964 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.1 p -66.48 -13.7 61.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.395 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.499 HD11 HD12 ' A' ' 28' ' ' LEU . 87.3 mt -67.51 -7.4 25.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.244 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.8 p -95.7 15.33 20.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.561 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -95.01 136.93 34.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -67.3 -1.87 5.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.025 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -84.59 153.24 23.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.77 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.4 p-90 -104.43 -38.64 6.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.954 0.407 . . . . 0.0 110.53 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.42 ' HG3' HG13 ' A' ' 38' ' ' ILE . 13.7 ptm180 -62.82 -39.03 93.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.79 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.42 HG13 ' HG3' ' A' ' 37' ' ' ARG . 50.8 mt -79.36 -47.99 21.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.934 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.472 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 38.3 ttm180 -63.5 -28.51 70.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.601 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.69 -59.02 6.37 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.423 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.14 -29.63 22.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.741 0.305 . . . . 0.0 110.976 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.67 -55.49 23.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.412 ' O ' HG22 ' A' ' 46' ' ' ILE . . . -69.48 -22.89 63.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.193 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.1 m95 -66.12 -28.31 68.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.614 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.8 mt -99.6 -23.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.71 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.412 HG22 ' O ' ' A' ' 43' ' ' ALA . 0.6 OUTLIER -61.08 -32.69 53.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.503 -179.248 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.62 -16.58 63.52 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.552 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.548 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.9 OUTLIER -68.97 -27.04 65.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.837 0.351 . . . . 0.0 110.681 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.442 ' C ' ' H ' ' A' ' 51' ' ' ASP . 56.5 m-85 -99.05 112.77 24.81 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.801 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.642 ' H ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -77.98 36.58 0.23 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.817 179.473 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.442 ' H ' ' C ' ' A' ' 49' ' ' PHE . 33.9 t70 -95.37 165.53 12.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.992 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.48 -31.31 72.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.518 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.433 ' HB3' ' CE2' ' A' ' 24' ' ' PHE . 41.5 ttm180 -69.17 -14.15 62.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.425 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.37 5.19 31.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.031 0.444 . . . . 0.0 110.641 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.639 ' HA ' ' NH2' ' A' ' 84' ' ' ARG . 98.9 t -87.03 -46.9 16.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.804 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.451 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 34.2 tt0 -60.34 -48.25 94.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.451 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 81.0 Cg_exo -42.14 -52.09 4.36 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.405 2.07 . . . . 0.0 112.817 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.473 HD21 ' HA ' ' A' ' 73' ' ' ALA . 6.8 mt -60.62 -37.0 79.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.333 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.9 mm -55.21 -59.43 2.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.477 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.19 -15.77 62.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.24 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.763 HD22 ' H ' ' A' ' 73' ' ' ALA . 0.4 OUTLIER -74.14 -52.66 11.85 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -178.892 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.49 HD23 HD21 ' A' ' 92' ' ' LEU . 7.9 mt -57.06 -10.34 1.12 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.306 -179.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -111.99 -13.44 13.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.618 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -61.14 -32.23 71.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.799 0.333 . . . . 0.0 111.78 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.511 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 32.9 m-20 48.26 32.12 2.98 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.07 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.444 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 29.3 t -83.07 -24.42 32.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.494 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.43 -85.39 0.39 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.95 -0.643 . . . . 0.0 111.556 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.89 -42.43 99.77 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.646 HG13 ' HG ' ' A' ' 61' ' ' LEU . 13.6 t -69.33 -56.86 10.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.056 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.511 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 7.3 tmm_? -54.67 -51.65 64.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.544 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.6 m -63.96 -19.92 65.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.377 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.49 -65.12 3.65 Favored Glycine 0 C--O 1.228 -0.222 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.572 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.763 ' H ' HD22 ' A' ' 61' ' ' LEU . . . -49.77 -31.23 11.06 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.63 -46.54 73.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.788 0.328 . . . . 0.0 111.35 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 6.8 ptp180 -82.23 -24.45 34.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.853 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.527 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 49.6 m -63.52 -38.94 93.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.512 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.6 mt -58.92 -59.96 4.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.137 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.449 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 38.8 mt-10 -46.23 -32.67 3.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.132 179.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.527 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 20.6 mt-30 -70.81 -41.5 71.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.348 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.476 HD12 ' HE ' ' A' ' 84' ' ' ARG . 59.9 mt -75.28 -61.43 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.86 -179.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.429 ' HA2' HG22 ' A' ' 85' ' ' VAL . . . 65.64 168.51 2.36 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.673 -0.775 . . . . 0.0 113.006 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.58 -170.59 24.4 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.895 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -64.89 -24.48 67.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.156 0.503 . . . . 0.0 110.419 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.639 ' NH2' ' HA ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER -54.83 -62.37 1.7 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.63 179.719 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.677 HG22 ' HH ' ' A' ' 107' ' ' TYR . 16.1 m -63.22 -24.75 36.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.27 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.457 ' HD3' ' HE2' ' A' ' 89' ' ' MET . 0.2 OUTLIER -54.62 -33.36 60.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.366 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.21 -24.27 24.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.713 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.431 ' HB3' ' NH1' ' A' ' 84' ' ' ARG . . . -70.27 -49.06 53.72 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.457 ' HE2' ' HD3' ' A' ' 86' ' ' ARG . 0.7 OUTLIER -70.18 -30.51 67.65 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.639 0.257 . . . . 0.0 110.888 -179.14 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -69.8 -43.4 72.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.7 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -67.91 -28.99 67.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.716 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.49 HD21 HD23 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -86.33 -27.84 24.06 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.999 179.702 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.9 -22.91 65.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.578 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -80.23 -26.67 38.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.494 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 59.8 p -122.65 23.58 9.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.374 0.606 . . . . 0.0 109.471 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.527 ' HA3' ' HG2' ' A' ' 101' ' ' ARG . . . -58.31 124.94 38.02 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 115.036 -0.984 . . . . 0.0 113.128 -179.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.406 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 2.3 t -141.23 130.15 23.13 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.72 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 62.63 -140.18 45.85 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.406 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 70' ' ' ARG . 62.2 t80 -62.07 -35.5 78.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.758 0.313 . . . . 0.0 110.66 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.473 ' HB3' ' HD3' ' A' ' 70' ' ' ARG . . . -54.44 -36.53 64.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.253 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.527 ' HG2' ' HA3' ' A' ' 96' ' ' GLY . 1.3 tmt_? -68.83 -61.78 1.66 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.466 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -52.11 -22.53 4.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.295 -179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.1 t -67.07 -53.15 36.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.536 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.431 ' O ' HD22 ' A' ' 108' ' ' LEU . . . -54.81 -62.61 1.54 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.068 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.494 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 23.5 t -54.78 -57.67 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.397 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.14 -32.5 66.43 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.677 ' HH ' HG22 ' A' ' 85' ' ' VAL . 34.9 t80 -63.3 -25.35 68.27 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 120.759 0.314 . . . . 0.0 111.161 -178.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.494 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.8 mm? -50.91 -26.89 6.46 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.01 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -53.91 -13.58 0.79 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.36 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 34.7 p -119.75 -87.49 0.64 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.305 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.624 ' HB2' ' HH ' ' A' ' 107' ' ' TYR . 15.7 m-70 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.952 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.895 0.378 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.437 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 0.4 OUTLIER -52.62 -48.27 66.47 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.021 179.464 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.514 ' HG3' ' NH1' ' A' ' 53' ' ' ARG . 3.6 mt-10 -62.21 -57.02 25.68 Favored Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.444 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 1.9 Cg_endo -50.72 -19.18 4.85 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.996 1.797 . . . . 0.0 111.498 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.494 HD21 HG13 ' A' ' 46' ' ' ILE . 0.8 OUTLIER -81.63 -39.91 23.72 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.697 179.367 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.598 HD23 ' HB3' ' A' ' 53' ' ' ARG . 10.8 tp -80.26 -22.15 41.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.364 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -73.95 -34.63 64.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.626 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.0 m -66.17 -17.19 64.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.12 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.503 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 51.3 mt -68.23 -6.59 24.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.862 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.1 m -103.19 11.24 37.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.758 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -71.1 142.15 50.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.821 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -59.51 -34.53 72.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.346 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -81.4 144.33 31.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.973 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.1 p90 -87.3 -32.8 19.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.016 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -58.77 -35.62 73.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.468 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.2 mm -80.83 -41.4 19.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.492 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.503 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 29.5 ttm180 -63.26 -20.02 65.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.629 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.81 -62.88 3.58 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.707 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.62 -33.04 2.64 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.644 0.259 . . . . 0.0 111.438 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.426 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.02 -52.75 63.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.916 0.389 . . . . 0.0 110.085 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.451 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -64.47 -28.71 69.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.74 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -66.97 -36.69 82.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.124 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.1 mm -99.29 -22.29 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.528 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.2 tt -61.04 -38.94 80.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -178.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.75 -6.59 17.87 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.256 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.585 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.8 OUTLIER -70.59 -49.77 44.22 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.514 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -65.69 -26.81 67.94 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.503 ' HG2' HG12 ' A' ' 80' ' ' ILE . 2.0 mt-30 61.07 16.29 6.97 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.783 0.325 . . . . 0.0 111.4 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.439 ' O ' HG21 ' A' ' 55' ' ' VAL . 18.9 t70 -84.11 -178.72 7.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.033 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.41 ' H ' ' CG ' ' A' ' 51' ' ' ASP . 9.8 pt-20 -61.54 -37.24 83.06 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -179.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.598 ' HB3' HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -67.19 -10.6 52.14 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.888 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.98 -9.42 17.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.975 0.417 . . . . 0.0 111.273 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.439 HG21 ' O ' ' A' ' 51' ' ' ASP . 62.5 t -82.02 -47.88 18.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.934 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.466 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 4.7 tp10 -60.1 -48.31 94.76 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.528 ' HG2' HD13 ' A' ' 46' ' ' ILE . 83.9 Cg_exo -43.0 -53.07 4.26 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.289 1.993 . . . . 0.0 112.664 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.495 HD11 HD23 ' A' ' 77' ' ' LEU . 16.3 mt -53.54 -34.22 57.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.046 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 42.9 mm -63.29 -61.15 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.533 ' HG3' HD13 ' A' ' 61' ' ' LEU . 16.8 pttt -72.19 -19.09 61.8 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.533 HD13 ' HG3' ' A' ' 60' ' ' LYS . 1.5 mp -77.77 -51.1 11.07 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.557 ' HB3' ' HB3' ' A' ' 100' ' ' ALA . 69.4 mt -63.43 -9.01 10.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.225 0.536 . . . . 0.0 109.972 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -112.94 -16.23 12.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.478 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.415 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.9 OUTLIER -61.09 -54.44 44.61 Favored 'General case' 0 CA--C 1.517 -0.288 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.307 -179.571 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 12.5 t70 72.02 25.5 3.02 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.738 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.45 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 69.0 m -81.21 -4.92 57.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.993 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.53 -101.84 2.45 Favored Glycine 0 C--O 1.229 -0.193 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.656 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.16 -30.46 37.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.262 0.553 . . . . 0.0 109.928 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.529 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.0 t -73.6 -46.83 46.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.198 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -70.46 -60.51 2.22 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.686 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.6 m -54.16 -28.34 39.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.872 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.88 -37.74 94.85 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.447 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.401 ' HB1' HD22 ' A' ' 61' ' ' LEU . . . -79.8 -37.08 36.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.653 0.263 . . . . 0.0 110.987 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -46.26 -35.06 4.89 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.157 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.405 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 1.2 ptp85 -83.91 -33.51 24.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.652 0.263 . . . . 0.0 111.453 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.442 ' HA ' HE21 ' A' ' 79' ' ' GLN . 66.4 m -57.84 -37.43 73.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.891 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.517 ' HA ' HG13 ' A' ' 85' ' ' VAL . 4.1 mm? -55.33 -61.22 2.48 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 110.95 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -65.25 -24.69 67.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.677 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.442 HE21 ' HA ' ' A' ' 76' ' ' SER . 3.2 tt0 -60.89 -58.49 8.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.8 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.503 HG12 ' HG2' ' A' ' 50' ' ' GLN . 95.4 mt -63.29 -52.02 63.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.101 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 55.39 76.43 0.19 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.663 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -174.68 -179.76 45.48 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.598 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -59.64 -21.48 60.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.951 0.405 . . . . 0.0 110.699 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.522 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 1.2 mpt_? -59.7 -64.33 0.98 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.333 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.517 HG13 ' HA ' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -70.84 -20.59 22.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.931 179.351 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -52.88 -33.09 48.42 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.933 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.55 -26.34 35.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.441 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.17 -45.0 64.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.008 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.578 ' HE3' ' HG ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -68.88 -29.77 68.13 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.488 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -70.82 -31.32 68.01 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.077 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -74.45 -31.4 62.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.191 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.529 HD21 ' HB3' ' A' ' 104' ' ' ALA . 1.7 tp -86.55 -32.23 20.81 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.776 0.322 . . . . 0.0 110.172 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -54.91 -28.06 47.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.162 0.506 . . . . 0.0 110.265 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -83.21 -25.46 31.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.205 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 54.2 p -116.12 32.08 6.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.008 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.554 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -46.51 121.41 5.66 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.307 -0.86 . . . . 0.0 113.771 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.0 m -150.47 130.71 13.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.777 0.322 . . . . 0.0 110.403 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.9 -139.72 28.97 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.348 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -89.6 -18.48 26.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.824 0.345 . . . . 0.0 110.367 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.557 ' HB3' ' HB3' ' A' ' 62' ' ' LEU . . . -54.18 -43.96 71.14 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.594 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.554 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 55.4 ttp180 -51.84 -57.95 7.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.31 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -56.55 -32.15 64.86 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.094 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.551 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 18.9 t -64.14 -41.83 93.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.227 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.529 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -64.51 -57.18 9.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.056 0.455 . . . . 0.0 111.872 -179.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 6.3 p -64.93 -54.26 31.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.879 -178.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.448 ' N ' HG11 ' A' ' 105' ' ' VAL . 5.1 t30 -55.55 -34.36 64.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.588 0.232 . . . . 0.0 111.404 -179.123 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.83 -31.68 68.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.46 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.578 ' HG ' ' HE3' ' A' ' 89' ' ' MET . 1.3 mt -49.96 -20.29 0.89 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.53 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -69.08 5.06 1.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.449 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' THR . . . . . 0.418 ' H ' ' C ' ' A' ' 108' ' ' LEU . 20.8 m -108.48 -72.51 0.72 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.711 0.291 . . . . 0.0 111.329 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 84.4 t60 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.735 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.566 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.183 0 CA-C-O 120.922 0.392 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.3 t80 -62.26 -40.43 96.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 121.315 0.578 . . . . 0.0 109.526 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.495 ' HG2' ' NH1' ' A' ' 53' ' ' ARG . 43.2 mt-10 -63.41 -56.2 28.92 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.881 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.566 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 77.2 Cg_exo -37.2 -29.23 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.24 0 C-N-CA 122.639 2.226 . . . . 0.0 111.695 179.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 81.7 mt -72.68 -58.41 3.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.588 178.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.52 ' HA ' HD13 ' A' ' 31' ' ' LEU . 49.1 tp -61.27 -24.88 66.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.783 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -79.1 -44.6 21.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.765 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.5 p -65.54 -11.73 46.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.0 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.523 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 43.5 mt -70.21 -6.84 37.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.129 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 77.7 p -111.98 13.89 20.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.776 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.682 HD22 ' HB2' ' A' ' 35' ' ' ASP . 0.8 OUTLIER -69.09 147.67 51.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.017 179.972 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -56.82 -44.12 81.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.395 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.682 ' HB2' HD22 ' A' ' 33' ' ' ASN . 10.9 m-20 -75.85 163.27 27.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.055 0.455 . . . . 0.0 111.388 -179.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -103.72 -29.59 10.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.737 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -63.53 -32.97 74.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.218 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.3 mt -81.16 -41.8 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.847 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.523 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 32.7 ttm180 -61.75 -29.8 70.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.724 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -56.11 -63.25 5.48 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.348 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.27 -29.28 9.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.545 0.212 . . . . 0.0 111.479 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.56 -52.08 59.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.873 0.368 . . . . 0.0 110.531 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.01 -31.35 71.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.687 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -70.7 -28.29 64.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.254 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 81.2 mt -98.76 -27.99 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.841 0.353 . . . . 0.0 111.655 -179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.422 HD11 ' HG2' ' A' ' 57' ' ' PRO . 1.5 tt -60.31 -30.36 46.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.827 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.42 -20.8 63.81 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.939 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -65.79 -23.85 66.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.846 0.355 . . . . 0.0 110.445 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.517 ' C ' ' H ' ' A' ' 51' ' ' ASP . 9.1 m-85 -95.29 109.5 21.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.486 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -71.85 16.66 0.11 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.3 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.517 ' H ' ' C ' ' A' ' 49' ' ' PHE . 37.1 t70 -84.04 161.56 20.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.641 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.91 -28.7 69.13 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.552 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.495 ' NH1' ' HG2' ' A' ' 25' ' ' GLU . 12.7 ttm180 -63.91 -13.95 49.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.024 0.44 . . . . 0.0 110.489 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.405 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -105.19 -10.61 16.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.486 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.408 HG11 ' HB3' ' A' ' 88' ' ' ALA . 68.2 t -82.23 -36.11 13.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.625 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.541 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 3.8 tp10 -60.37 -49.97 87.96 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.274 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.541 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 82.8 Cg_exo -45.14 -51.27 7.89 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.287 1.991 . . . . 0.0 111.892 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.606 HD11 HD21 ' A' ' 77' ' ' LEU . 4.8 mt -54.73 -35.04 63.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.624 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.53 HG23 ' HD2' ' A' ' 91' ' ' LYS . 46.2 mm -60.77 -60.76 2.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.822 0.344 . . . . 0.0 111.566 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -71.48 -10.85 60.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.103 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.533 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.7 mp -88.62 -48.05 7.83 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.495 HD13 HD23 ' A' ' 92' ' ' LEU . 26.5 mt -60.32 -12.31 8.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.971 0.415 . . . . 0.0 110.798 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -113.93 -11.97 12.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.816 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -61.12 -44.95 96.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.101 0.477 . . . . 0.0 111.089 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.624 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 28.5 m-20 66.93 22.22 10.17 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.944 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.482 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 39.6 m -86.38 16.06 4.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.637 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.08 -100.27 0.84 Allowed Glycine 0 C--O 1.227 -0.319 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.857 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -46.86 -40.97 14.97 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.076 0.465 . . . . 0.0 110.741 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.533 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.4 t -71.26 -51.11 36.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.45 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.624 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 53.7 ttp180 -62.3 -60.64 3.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.22 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 88.5 p -53.98 -34.13 58.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.993 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.48 -26.71 57.31 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.056 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.418 ' CB ' ' HA ' ' A' ' 58' ' ' LEU . . . -88.12 -39.77 14.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.787 0.327 . . . . 0.0 110.878 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.07 -34.99 59.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.099 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -80.66 -23.97 39.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.937 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.623 ' HA ' HE21 ' A' ' 79' ' ' GLN . 74.6 m -67.07 -39.07 86.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.291 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.606 HD21 HD11 ' A' ' 58' ' ' LEU . 4.2 mm? -55.36 -57.02 13.58 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.826 0.345 . . . . 0.0 110.565 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.91 -34.75 78.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.363 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.623 HE21 ' HA ' ' A' ' 76' ' ' SER . 0.2 OUTLIER -56.37 -44.61 80.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.254 -179.713 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 92.2 mt -78.22 -59.73 2.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.853 0.359 . . . . 0.0 110.752 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.61 97.77 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.599 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.424 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 170.16 -177.48 43.44 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.484 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -68.83 -30.97 69.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.572 0.225 . . . . 0.0 110.972 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.552 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.57 -53.22 60.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.821 0.343 . . . . 0.0 110.438 179.732 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.552 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -70.82 -24.07 24.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.267 179.311 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 86' ' ' ARG . 18.1 ttt180 -58.84 -38.09 77.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.419 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.32 -22.86 59.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.757 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.408 ' HB3' HG11 ' A' ' 55' ' ' VAL . . . -71.52 -46.83 58.54 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.993 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.6 ' HE3' ' HB3' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -72.23 -32.69 66.94 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.6 179.701 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.477 ' HG3' ' HE2' ' A' ' 89' ' ' MET . 27.1 mt-10 -59.16 -41.46 88.44 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 179.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.53 ' HD2' HG23 ' A' ' 59' ' ' ILE . 9.3 tmtm? -64.49 -23.6 67.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.636 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.495 HD23 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -87.1 -28.37 22.56 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.881 179.223 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.26 -30.97 72.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.317 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.444 ' HG3' HG21 ' A' ' 95' ' ' THR . 13.5 pt-20 -80.15 -18.63 49.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.967 0.413 . . . . 0.0 110.366 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.444 HG21 ' HG3' ' A' ' 94' ' ' GLU . 51.2 p -123.98 25.53 7.9 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -65.89 127.01 30.12 Favored Glycine 0 N--CA 1.443 -0.871 0 CA-C-N 115.011 -0.995 . . . . 0.0 113.343 -178.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.1 t -141.92 131.83 24.44 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.27 -0.465 . . . . 0.0 111.138 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.02 -127.13 42.33 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.821 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.409 ' O ' HG23 ' A' ' 103' ' ' VAL . 52.2 t80 -66.46 -40.02 89.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.596 0.236 . . . . 0.0 111.058 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.52 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -50.67 -41.17 55.25 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.605 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.415 ' CD ' ' HA3' ' A' ' 96' ' ' GLY . 7.9 tpt180 -64.33 -59.11 4.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.092 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -50.02 -23.27 1.95 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.146 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.52 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 13.6 t -66.45 -60.27 2.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.587 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.527 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.26 -53.23 60.41 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 10.2 p -60.79 -50.07 82.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.412 ' N ' HG12 ' A' ' 105' ' ' VAL . 58.1 t30 -70.75 -30.67 67.25 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.431 ' HD2' ' HG2' ' A' ' 89' ' ' MET . 7.4 t80 -64.56 -49.07 72.67 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -177.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.6 ' HB3' ' HE3' ' A' ' 89' ' ' MET . 3.8 pp -55.03 -12.14 0.8 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.238 -178.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -65.87 -30.27 70.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.917 0.389 . . . . 0.0 110.692 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 22.0 p -112.61 -42.24 3.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.161 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 29.9 p80 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.529 -0.748 . . . . 0.0 111.488 179.74 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.531 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.453 -0.318 0 CA-C-O 120.455 0.169 . . . . 0.0 111.392 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.5 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 5.6 t80 -41.96 -55.91 2.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.42 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.41 -58.77 14.11 Favored Pre-proline 0 C--N 1.324 -0.507 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.485 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 66.9 Cg_exo -40.51 -36.5 1.78 Allowed 'Trans proline' 0 C--N 1.361 1.217 0 C-N-CA 122.622 2.214 . . . . 0.0 112.462 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 3.8 mm? -53.03 -57.06 11.66 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.115 0.483 . . . . 0.0 110.282 178.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.444 HD11 HD11 ' A' ' 31' ' ' LEU . 1.1 tp -74.3 -31.51 62.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.693 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 26' ' ' PRO . 43.2 mt-10 -64.53 -29.77 70.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.584 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.0 t -66.38 -17.35 64.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.226 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.444 HD11 HD11 ' A' ' 28' ' ' LEU . 86.9 mt -67.53 -6.38 19.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 110.741 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.4 p -121.95 21.52 10.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -86.02 149.07 25.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.892 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.65 -31.75 73.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.368 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -82.54 163.3 21.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.734 0.302 . . . . 0.0 110.918 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -110.89 -41.75 4.17 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.476 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -58.9 -29.44 67.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.05 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.14 -42.86 27.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.718 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.495 ' HD2' HG23 ' A' ' 69' ' ' VAL . 33.7 ttm180 -61.99 -20.45 63.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.305 179.457 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.89 -66.26 2.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.282 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.69 -28.27 5.77 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.693 0.282 . . . . 0.0 111.216 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.507 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -62.57 -56.99 12.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.498 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.471 ' HB3' HD22 ' A' ' 61' ' ' LEU . . . -63.68 -31.54 72.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.785 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -70.87 -34.31 71.49 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.784 -178.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.4 mt -99.24 -21.22 5.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.851 0.358 . . . . 0.0 111.852 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.507 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 7.0 tt -61.06 -33.41 55.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -69.51 -22.46 76.53 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.663 -0.78 . . . . 0.0 113.152 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -70.81 -10.95 60.58 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -84.57 -34.82 23.13 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.664 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.3 OUTLIER 59.74 47.09 10.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.977 0.418 . . . . 0.0 110.952 -179.67 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.42 ' O ' HG23 ' A' ' 55' ' ' VAL . 10.8 t70 -127.5 178.84 5.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.19 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -60.81 -43.89 97.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.99 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 24' ' ' PHE . 15.6 mmt180 -64.47 -10.81 27.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.724 0.297 . . . . 0.0 111.224 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.23 5.47 32.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.642 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 51' ' ' ASP . 94.6 t -90.7 -55.65 6.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.123 -179.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.452 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 31.9 tt0 -57.64 -48.87 96.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.477 ' HG2' HD11 ' A' ' 46' ' ' ILE . 80.2 Cg_exo -42.64 -53.3 3.91 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.379 2.053 . . . . 0.0 112.619 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.543 HD11 HD22 ' A' ' 77' ' ' LEU . 12.3 mt -54.27 -38.77 66.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.71 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 51.0 mm -60.71 -60.2 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -70.1 -7.78 44.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.89 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.631 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.0 OUTLIER -89.49 -42.85 11.23 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.507 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.551 HD12 HD21 ' A' ' 92' ' ' LEU . 8.1 mt -62.13 -9.36 7.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.257 0.551 . . . . 0.0 110.256 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -123.82 -4.79 8.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.635 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.477 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 25.5 t0 -61.06 -29.16 69.57 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.148 0.499 . . . . 0.0 111.107 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.665 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 12.3 t70 55.13 26.24 8.03 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.473 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.482 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 45.9 t -86.28 -3.38 58.97 Favored 'General case' 0 C--N 1.334 -0.104 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.127 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.12 -70.87 2.71 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.867 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.99 -54.53 14.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.216 0.532 . . . . 0.0 109.636 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.631 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.5 t -68.86 -30.31 46.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.272 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.665 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 41.7 ttt180 -71.45 -63.29 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.819 0.342 . . . . 0.0 111.079 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.5 m -61.81 -21.29 64.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.269 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -65.19 -22.17 68.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.341 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.404 ' O ' ' N ' ' A' ' 76' ' ' SER . . . -88.46 -49.85 6.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -44.16 -32.63 1.28 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.727 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 75' ' ' ARG . 6.2 ptp180 -79.75 -34.18 40.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 0.0 110.969 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.439 ' HB2' HD21 ' A' ' 58' ' ' LEU . 70.9 m -63.77 -35.99 82.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.453 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.543 HD22 HD11 ' A' ' 58' ' ' LEU . 3.9 mm? -55.46 -59.13 5.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.836 0.35 . . . . 0.0 110.318 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.453 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 34.3 tt0 -63.6 -26.37 68.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.948 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.41 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 8.2 mt-30 -62.32 -51.2 68.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.63 179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.664 HG12 ' HG3' ' A' ' 50' ' ' GLN . 69.0 mt -65.73 -55.59 18.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.681 179.576 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.541 ' HA2' ' HH ' ' A' ' 107' ' ' TYR . . . 65.78 116.67 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.716 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 149.5 177.34 23.5 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.431 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -63.11 -22.41 66.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.815 0.34 . . . . 0.0 110.976 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.476 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -63.09 -58.76 6.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.388 -179.811 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.469 ' H ' ' HG2' ' A' ' 84' ' ' ARG . 4.2 m -70.48 -22.93 24.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.927 0.394 . . . . 0.0 111.288 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -58.71 -35.16 72.21 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.944 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.71 -29.05 67.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.287 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.7 70.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.691 179.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.559 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 17.7 mmm -68.51 -51.72 39.98 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.38 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -54.95 -35.96 64.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.904 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.6 tmtm? -77.73 -25.91 49.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.491 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.551 HD21 HD12 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -86.59 -21.56 26.75 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.156 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.73 -21.13 59.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.725 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -80.35 -24.79 39.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.286 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 81.4 p -122.55 14.82 10.28 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.423 ' C ' ' HB2' ' A' ' 101' ' ' ARG . . . -61.24 128.27 43.88 Favored Glycine 0 N--CA 1.444 -0.782 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.989 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.478 HG21 HH22 ' A' ' 70' ' ' ARG . 4.3 t -139.82 130.16 25.38 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.916 0.389 . . . . 0.0 111.169 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.06 -108.84 2.44 Favored Glycine 0 CA--C 1.519 0.302 0 C-N-CA 121.113 -0.565 . . . . 0.0 113.282 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.42 ' O ' HG22 ' A' ' 103' ' ' VAL . 53.3 t80 -85.6 -40.35 16.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.655 0.264 . . . . 0.0 111.541 -179.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.443 ' O ' HD22 ' A' ' 92' ' ' LEU . . . -48.43 -38.1 18.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 112.059 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.423 ' HB2' ' C ' ' A' ' 96' ' ' GLY . 42.5 ttt180 -73.82 -56.49 4.91 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.484 ' HG3' ' ND2' ' A' ' 106' ' ' ASN . 2.2 tpmt? -46.67 -21.71 0.22 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.179 0.514 . . . . 0.0 110.813 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 99' ' ' PHE . 37.5 t -74.49 -59.69 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.912 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.444 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.37 -44.48 84.44 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.404 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 51.7 t -63.9 -64.07 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -177.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.484 ' ND2' ' HG3' ' A' ' 102' ' ' LYS . 91.8 m-20 -60.21 -37.57 80.7 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.559 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 24.8 t80 -60.74 -32.42 71.7 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 120.789 0.328 . . . . 0.0 111.074 -178.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 35.6 mt -54.19 -18.24 3.63 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.534 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -71.94 1.62 6.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.099 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 18.9 m -114.24 -80.09 0.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.187 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 61.0 m80 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.948 -179.966 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.518 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.144 0 CA-C-O 120.939 0.399 . . . . 0.0 110.702 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.477 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 11.7 t80 -54.71 -59.98 3.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.342 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.41 -55.56 34.38 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.106 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.518 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 98.5 Cg_exo -42.43 -31.66 1.93 Allowed 'Trans proline' 0 C--N 1.36 1.174 0 C-N-CA 122.298 1.998 . . . . 0.0 111.74 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 33.5 mt -67.91 -58.62 4.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.305 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.533 HD13 HD11 ' A' ' 31' ' ' LEU . 13.7 tp -62.06 -21.92 65.33 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.376 179.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -77.2 -27.47 53.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.634 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.457 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 74.1 m -64.43 -25.81 68.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.977 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.657 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 87.9 mt -65.27 -17.05 64.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.806 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.0 m -102.4 16.37 26.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.107 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.457 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 92.4 m-20 -95.29 143.88 26.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.995 0.426 . . . . 0.0 111.26 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -67.78 -16.51 64.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.903 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -85.33 160.7 19.75 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.66 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 7.3 p90 -109.17 -35.96 6.17 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.455 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.422 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 71.3 ttt180 -60.26 -32.07 70.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.824 0.345 . . . . 0.0 111.224 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 59.3 mt -82.43 -38.39 15.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.501 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.657 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 43.1 ttm180 -64.58 -46.79 81.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.423 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -59.49 -47.89 88.65 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.67 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.93 -27.96 54.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.716 0.293 . . . . 0.0 111.253 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.445 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.33 -56.42 22.36 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.038 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.54 -28.54 69.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.948 0.404 . . . . 0.0 110.801 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.3 m95 -55.4 -42.87 74.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.228 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.8 mt -99.08 -20.37 5.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.545 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.498 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.2 OUTLIER -56.81 -37.33 53.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.58 -179.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.01 -20.5 60.26 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.93 -0.653 . . . . 0.0 113.399 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -69.83 -21.12 63.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -82.61 -27.74 31.27 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.609 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.0 OUTLIER 57.66 27.25 13.99 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.94 0.4 . . . . 0.0 111.38 179.828 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -100.96 158.38 16.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.162 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -56.77 -36.75 70.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.477 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.527 ' HD2' ' O ' ' A' ' 53' ' ' ARG . 0.8 OUTLIER -63.73 -27.55 69.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.891 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.498 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -96.11 0.14 50.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.228 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.6 t -90.83 -41.05 13.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.392 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.542 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 19.1 tt0 -60.61 -49.18 91.02 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 50.5 Cg_exo -54.03 -17.35 10.93 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.647 2.231 . . . . 0.0 113.222 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.47 HD22 ' HA ' ' A' ' 73' ' ' ALA . 12.9 mt -86.54 -31.79 21.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.844 0.354 . . . . 0.0 110.93 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.6 mm -63.33 -52.62 56.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.984 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -70.17 -44.55 68.54 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.592 ' HG ' HG13 ' A' ' 69' ' ' VAL . 2.0 tp -57.66 -35.74 70.96 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -177.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.572 HD13 HD23 ' A' ' 92' ' ' LEU . 35.2 mt -59.01 -12.08 4.22 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -113.08 -3.6 13.96 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.98 -33.62 73.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.153 0.501 . . . . 0.0 111.117 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.545 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 17.9 t70 50.34 26.77 2.4 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.373 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.461 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.6 t -82.37 -17.34 45.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.943 0.401 . . . . 0.0 110.372 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 122.2 -114.45 2.5 Favored Glycine 0 N--CA 1.452 -0.254 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.444 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.422 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -55.06 -27.94 48.53 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.376 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.592 HG13 ' HG ' ' A' ' 61' ' ' LEU . 39.5 t -64.92 -38.94 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.621 178.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.545 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 44.1 ttp180 -74.69 -40.15 61.55 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.595 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 55.0 m -64.85 -33.74 76.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.09 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.35 -60.35 8.67 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.444 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.47 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -57.12 -31.53 65.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.872 0.368 . . . . 0.0 111.048 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.97 -59.05 5.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.737 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -67.11 -37.51 84.0 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.098 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.418 ' O ' ' HB3' ' A' ' 79' ' ' GLN . 60.7 p -53.29 -40.22 64.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.752 0.31 . . . . 0.0 111.237 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.419 ' HB3' HG12 ' A' ' 85' ' ' VAL . 35.2 mt -67.7 -60.17 2.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.828 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -53.18 -25.8 15.0 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.111 0.481 . . . . 0.0 110.219 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.433 HE21 ' HB3' ' A' ' 79' ' ' GLN . 4.7 tt0 -68.23 -41.55 81.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.066 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.609 HG12 ' HG3' ' A' ' 50' ' ' GLN . 89.3 mt -63.13 -55.4 23.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.727 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.509 ' HA2' ' HH ' ' A' ' 107' ' ' TYR . . . 66.24 119.34 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.57 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.77 -179.97 27.92 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.278 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -66.38 -33.96 76.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.72 0.295 . . . . 0.0 110.922 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.472 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -62.97 -38.31 90.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.11 -179.78 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.445 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 19.8 t -64.8 -37.16 79.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.819 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 39.4 ttp180 -59.19 -27.36 65.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.513 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.29 76.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.025 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.65 88.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.929 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.52 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 14.4 mmt -66.77 -49.41 65.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.691 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -56.42 -34.98 67.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.82 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.14 -27.59 48.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.985 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.572 HD23 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -86.17 -19.79 29.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.16 0.505 . . . . 0.0 109.745 179.663 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.69 -19.95 60.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.692 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.51 -27.6 37.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.332 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 15.6 p -120.18 18.3 12.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.333 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -53.48 125.92 33.12 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.968 -1.015 . . . . 0.0 113.268 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.4 t -139.79 130.32 25.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.035 0.445 . . . . 0.0 110.845 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.23 -121.29 26.17 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.005 -0.617 . . . . 0.0 113.132 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -75.87 -36.53 59.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.66 0.267 . . . . 0.0 111.685 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.475 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.84 -39.72 59.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.871 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -66.33 -59.98 3.2 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.485 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -45.7 -32.85 2.64 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.869 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 19.9 t -58.98 -59.92 3.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.656 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.477 ' HA ' ' SD ' ' A' ' 89' ' ' MET . . . -58.33 -56.4 22.56 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 88.6 t -59.46 -60.68 2.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -178.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -55.4 -37.42 67.58 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.52 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 43.5 t80 -62.84 -22.77 66.9 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 120.907 0.384 . . . . 0.0 110.958 -178.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.4 mt -58.39 -17.21 18.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.166 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -64.79 -24.08 67.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.662 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.1 p -102.39 -58.01 1.95 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.818 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 44.1 m80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.295 -0.86 . . . . 0.0 110.835 179.891 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.41 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.627 0.251 . . . . 0.0 111.395 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.489 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 1.5 t80 -63.34 -48.64 77.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.108 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.439 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 8.6 mt-10 -62.58 -58.1 18.76 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.949 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.8 Cg_endo -56.01 -15.54 14.01 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 121.859 1.706 . . . . 0.0 110.955 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.611 HD22 HG13 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -79.12 -38.81 35.24 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.593 179.293 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 24' ' ' PHE . 7.4 mt -82.18 -22.17 36.14 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.383 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.13 -31.96 69.41 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.512 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.458 ' OG ' HG21 ' A' ' 38' ' ' ILE . 1.5 t -66.18 -26.52 67.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.638 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.561 ' HA ' ' HD2' ' A' ' 39' ' ' ARG . 76.4 mt -56.35 -17.74 8.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.864 -179.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.2 m -90.7 21.73 3.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.612 0.244 . . . . 0.0 111.491 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -114.27 123.37 49.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.988 0.423 . . . . 0.0 111.313 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -67.88 -5.6 17.55 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.375 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -75.89 155.85 34.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 0.0 110.947 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.3 p-90 -89.79 -35.0 15.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.068 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -69.35 -33.24 72.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.901 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.458 HG21 ' OG ' ' A' ' 30' ' ' SER . 40.5 mm -82.11 -55.01 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.876 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.561 ' HD2' ' HA ' ' A' ' 31' ' ' LEU . 8.2 tpt180 -57.25 -40.37 77.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.053 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.27 -58.62 10.04 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.931 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.97 -27.31 0.88 Allowed 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.05 -56.78 9.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.843 0.354 . . . . 0.0 111.196 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.544 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -66.41 -37.22 84.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.953 0.406 . . . . 0.0 111.008 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -55.77 -33.4 64.31 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.723 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.3 mm -98.75 -20.45 5.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.187 0.518 . . . . 0.0 110.849 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.611 HG13 HD22 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -60.74 -41.38 88.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.754 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.483 ' HA3' HE21 ' A' ' 79' ' ' GLN . . . -59.75 -16.08 36.75 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.716 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -70.73 -43.34 69.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.474 0.178 . . . . 0.0 111.227 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -92.82 105.7 17.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.78 0.324 . . . . 0.0 110.631 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.514 ' HG3' ' HA ' ' A' ' 80' ' ' ILE . 23.7 mp0 -71.82 74.37 0.86 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.524 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -127.82 155.49 44.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.161 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -64.92 -29.13 70.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.424 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.401 ' HG2' HD13 ' A' ' 28' ' ' LEU . 33.4 ttm180 -69.26 -10.43 57.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.337 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.584 ' HB1' HG22 ' A' ' 46' ' ' ILE . . . -105.97 12.97 29.94 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.882 0.372 . . . . 0.0 111.009 -179.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 53.2 t -86.63 -50.11 14.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.009 -0.542 . . . . 0.0 112.182 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.48 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 42.1 tt0 -55.08 -48.43 96.11 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.48 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 94.5 Cg_exo -45.47 -33.77 9.8 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.426 2.084 . . . . 0.0 112.987 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.7 mt -75.17 -40.77 59.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.829 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.495 HD13 ' HA ' ' A' ' 88' ' ' ALA . 41.0 mm -54.78 -52.96 37.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.16 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -70.09 -22.33 63.05 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.494 ' HG ' HG13 ' A' ' 69' ' ' VAL . 3.0 mp -89.42 -40.13 12.93 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.513 HD13 HD22 ' A' ' 92' ' ' LEU . 13.3 mt -62.2 -10.88 11.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.349 0.595 . . . . 0.0 110.346 -179.238 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -90.67 -39.86 12.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.98 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.463 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 34.5 m-20 -56.52 -179.8 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.76 -178.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -153.33 29.7 0.49 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.762 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.422 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 53.3 m -83.66 -3.41 57.72 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.285 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.49 -98.75 2.41 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.392 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -48.69 -32.72 8.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.235 0.54 . . . . 0.0 110.012 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.494 HG13 ' HG ' ' A' ' 61' ' ' LEU . 60.1 t -72.8 -56.78 8.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.104 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 7.3 tmm_? -65.2 -63.66 1.05 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.339 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 97.3 p -52.05 -22.84 4.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.293 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.16 -43.65 98.33 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.594 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.606 ' HA ' ' HG ' ' A' ' 76' ' ' SER . . . -75.32 -36.84 61.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.573 0.225 . . . . 0.0 111.377 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.22 -40.47 64.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.526 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.3 ptp180 -84.45 -16.58 42.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.489 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.606 ' HG ' ' HA ' ' A' ' 73' ' ' ALA . 54.9 m -65.91 -45.05 83.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.792 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.541 ' HA ' HG23 ' A' ' 85' ' ' VAL . 5.0 mp -55.8 -59.4 4.93 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.454 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -53.74 -29.46 39.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.804 -0.18 . . . . 0.0 111.099 179.716 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.483 HE21 ' HA3' ' A' ' 47' ' ' GLY . 21.0 mt-30 -70.6 -31.99 69.18 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 121.018 0.437 . . . . 0.0 110.346 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.514 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 95.2 mt -80.43 -60.71 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.173 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.76 113.38 0.01 OUTLIER Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.978 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.91 164.1 12.0 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.633 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -64.03 -26.37 68.53 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.805 0.336 . . . . 0.0 110.837 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.568 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -65.95 -53.49 38.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.764 179.894 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.568 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 12.3 p -70.8 -24.77 25.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.389 0.614 . . . . 0.0 110.263 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.429 ' O ' ' HG3' ' A' ' 89' ' ' MET . 17.0 ttp180 -55.88 -20.87 17.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.72 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.02 -34.07 64.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.364 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.495 ' HA ' HD13 ' A' ' 59' ' ' ILE . . . -60.0 -48.58 81.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.851 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.532 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.23 -31.75 69.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.375 179.739 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.35 -36.51 83.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.164 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -79.94 -28.11 39.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.121 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.513 HD22 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -82.48 -24.03 34.42 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.78 -12.49 61.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.738 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -95.86 -14.87 22.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.914 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.0 p -135.12 16.99 3.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.598 0.713 . . . . 0.0 109.199 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -61.5 148.19 47.22 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 114.734 -1.121 . . . . 0.0 113.226 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.412 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 4.3 t -151.25 130.35 12.65 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.79 -0.705 . . . . 0.0 111.001 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.03 -130.11 50.53 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.976 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -60.42 -47.54 85.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.635 0.255 . . . . 0.0 111.389 -179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.422 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -50.17 -41.5 49.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.51 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.412 ' HB2' ' N ' ' A' ' 97' ' ' THR . 9.3 tpt180 -61.52 -61.68 2.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.384 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -53.3 -27.69 24.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.119 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.407 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 13.5 t -63.97 -45.79 95.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.954 -179.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.532 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -62.56 -58.95 5.74 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.474 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 7.3 p -64.43 -52.84 50.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.421 ' N ' HG12 ' A' ' 105' ' ' VAL . 27.1 t-20 -55.78 -32.49 63.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.646 0.26 . . . . 0.0 111.616 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -60.32 -29.24 68.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.058 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 14.1 mt -51.44 -22.36 2.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.65 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.74 3.69 3.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.268 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 53.7 m -105.37 -60.36 1.63 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.788 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.41 ' HD2' ' HD3' ' A' ' 86' ' ' ARG . 82.9 t60 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.638 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 27' ' ' LEU . . . . . . . . 0 N--CA 1.457 -0.115 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.47 -49.42 77.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.999 0.428 . . . . 0.0 110.805 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.412 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 10.8 mt-10 -63.42 -58.92 13.43 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.438 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.418 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 15.0 Cg_endo -56.46 -14.38 12.6 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 121.87 1.714 . . . . 0.0 111.062 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.534 HD12 HG12 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -82.9 -39.0 22.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.535 178.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.453 HD12 HD13 ' A' ' 31' ' ' LEU . 8.7 tp -85.86 -21.38 28.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.325 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -75.81 -37.56 58.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.708 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 60.9 p -65.3 -23.99 67.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.27 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.453 HD13 HD12 ' A' ' 28' ' ' LEU . 86.2 mt -59.2 -7.26 1.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.673 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.5 p -89.92 19.62 4.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.21 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.541 HD22 ' HG3' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -88.19 147.76 24.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.138 0.494 . . . . 0.0 111.432 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.84 -25.74 65.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.622 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.1 162.32 28.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.968 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -110.12 -26.05 9.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.95 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 37' ' ' ARG . 23.4 ttt180 -58.9 -48.16 82.42 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.742 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.4 mm -56.44 -49.85 75.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.339 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.541 ' HG3' HD22 ' A' ' 33' ' ' ASN . 77.8 mtt180 -52.81 -23.84 7.73 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.598 178.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -60.78 -66.59 2.6 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.484 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.3 -42.33 69.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.778 0.323 . . . . 0.0 111.224 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.449 ' HB3' HD11 ' A' ' 27' ' ' LEU . . . -58.02 -54.9 41.73 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.676 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.82 -34.72 74.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.6 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -68.7 -28.07 66.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.773 -179.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.2 mm -91.41 -21.6 6.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.927 0.394 . . . . 0.0 110.54 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.608 HG23 ' HB3' ' A' ' 54' ' ' ALA . 2.4 mm -55.78 -35.16 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.251 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.91 -28.26 63.19 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.869 -0.681 . . . . 0.0 113.022 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.696 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.6 OUTLIER -55.4 -51.44 66.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.9 0.381 . . . . 0.0 110.255 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.405 ' C ' ' H ' ' A' ' 51' ' ' ASP . 37.2 m-85 -83.98 115.58 22.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.741 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.68 25.4 0.78 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.132 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.435 ' O ' HG21 ' A' ' 55' ' ' VAL . 6.2 m-20 -84.0 162.45 20.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.376 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.429 ' HA ' HG21 ' A' ' 55' ' ' VAL . 0.2 OUTLIER -61.58 -37.06 82.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.589 -179.551 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.6 ttp180 -64.45 -11.32 32.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.986 0.422 . . . . 0.0 110.367 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.608 ' HB3' HG23 ' A' ' 46' ' ' ILE . . . -106.02 -10.99 16.3 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.709 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 51' ' ' ASP . 93.6 t -79.05 -44.51 24.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.654 -179.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.546 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -57.69 -51.06 84.51 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.496 -179.564 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.546 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.0 Cg_exo -45.29 -51.67 7.52 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.296 1.997 . . . . 0.0 112.252 179.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.526 HD22 ' HA ' ' A' ' 73' ' ' ALA . 16.7 mt -60.63 -35.57 76.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.484 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 55' ' ' VAL . 42.6 mm -62.78 -59.75 3.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.703 0.287 . . . . 0.0 111.585 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -4.97 23.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.693 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.632 ' HG ' HG11 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -89.59 -44.44 10.08 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -179.353 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.595 HD13 HD12 ' A' ' 77' ' ' LEU . 5.1 mt -56.74 -15.81 5.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.887 0.375 . . . . 0.0 111.4 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -110.85 -9.33 14.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.501 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -61.06 -33.43 73.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.108 0.48 . . . . 0.0 111.212 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.582 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 16.5 t70 54.84 28.98 11.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.688 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.467 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 37.8 t -85.33 -10.94 55.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.636 0.255 . . . . 0.0 111.404 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 96.09 -84.33 0.85 Allowed Glycine 0 C--O 1.228 -0.26 0 C-N-CA 120.712 -0.756 . . . . 0.0 111.97 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.66 -41.52 98.2 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.632 HG11 ' HG ' ' A' ' 61' ' ' LEU . 5.2 t -71.97 -43.46 67.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.133 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.582 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 8.3 ttt180 -69.52 -63.36 1.09 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.703 0.287 . . . . 0.0 111.027 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.9 m -52.49 -23.06 5.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.821 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -66.9 -37.43 92.19 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.147 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.526 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -69.72 -47.47 62.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.649 0.261 . . . . 0.0 111.003 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.23 -26.2 62.58 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.214 0.531 . . . . 0.0 110.002 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.9 ttt180 -82.93 -40.45 20.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.449 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.593 ' HA ' HE21 ' A' ' 79' ' ' GLN . 69.8 m -66.94 -33.24 75.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.676 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.595 HD12 HD13 ' A' ' 62' ' ' LEU . 96.8 mt -65.36 -59.72 3.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.675 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.411 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 36.8 tt0 -51.57 -23.09 3.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.161 0.505 . . . . 0.0 110.032 178.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.593 HE21 ' HA ' ' A' ' 76' ' ' SER . 1.1 tt0 -68.02 -48.14 66.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.985 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 82.2 mt -58.21 -60.22 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.713 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 61.13 107.16 0.01 OUTLIER Glycine 0 C--N 1.332 0.356 0 C-N-CA 121.092 -0.575 . . . . 0.0 113.07 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 155.33 -175.47 33.26 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.621 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -71.34 -26.81 62.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.842 0.353 . . . . 0.0 110.737 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.601 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -68.68 -49.71 56.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 -179.746 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.601 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 11.4 p -70.83 -26.93 28.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.276 0.56 . . . . 0.0 110.798 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.414 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 54.7 ttt180 -58.78 -24.59 62.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.532 -179.157 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.94 -29.0 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.93 0.395 . . . . 0.0 110.701 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.73 -37.68 88.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.71 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.568 ' HE2' ' HA ' ' A' ' 104' ' ' ALA . 6.7 mmm -66.76 -44.38 81.55 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 12.3 mm-40 -57.42 -38.63 74.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.146 178.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -74.49 -29.49 61.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.547 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.496 HD23 HD22 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -87.25 -23.48 24.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.005 0.431 . . . . 0.0 110.296 179.48 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.84 -29.16 69.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.422 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.521 ' HG3' HG23 ' A' ' 95' ' ' THR . 11.2 pt-20 -80.17 -18.13 50.53 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.245 0.545 . . . . 0.0 109.779 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.521 HG23 ' HG3' ' A' ' 94' ' ' GLU . 72.0 p -121.93 21.91 10.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.935 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.441 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -60.64 123.12 31.9 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 114.843 -1.071 . . . . 0.0 113.687 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.3 t -147.76 130.06 15.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.809 0.337 . . . . 0.0 110.786 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.7 -132.77 20.42 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.158 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -77.86 -30.89 51.13 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.658 0.266 . . . . 0.0 111.321 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.472 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -55.27 -37.92 67.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.468 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.441 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 44.5 ttt180 -67.41 -59.02 3.73 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.667 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.2 tppt? -47.33 -21.69 0.33 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.961 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.448 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 18.7 t -75.4 -56.98 7.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.92 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.568 ' HA ' ' HE2' ' A' ' 89' ' ' MET . . . -51.31 -57.6 8.44 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 113.502 0.926 . . . . 0.0 113.502 -178.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.8 t -58.35 -63.6 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -176.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -59.03 -35.2 72.91 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.519 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 42.9 t80 -63.29 -25.76 68.46 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-O 120.829 0.347 . . . . 0.0 111.116 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 96.8 mt -56.59 -20.79 22.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.882 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -62.65 -12.35 22.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.977 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.4 p -132.05 20.01 4.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.315 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 65.6 m80 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.065 179.59 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.442 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.72 0.295 . . . . 0.0 111.611 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.515 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 2.7 t80 -63.47 -48.84 76.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.819 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.493 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.3 -50.39 74.82 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -179.207 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.493 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 87.6 Cg_exo -41.93 -24.46 0.3 Allowed 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 122.204 1.936 . . . . 0.0 111.719 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 47.1 mt -76.06 -53.02 8.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.133 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.542 HD11 HD11 ' A' ' 31' ' ' LEU . 24.6 tp -66.98 -24.16 66.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.889 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -76.27 -42.71 44.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.558 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 52.3 m -66.43 -11.18 50.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.981 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.596 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 38.7 mt -67.17 -10.11 46.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.102 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.7 t -100.21 14.36 31.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.511 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -68.91 150.08 48.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.83 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -63.09 -39.4 94.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.038 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -76.12 156.75 33.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.797 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 7.5 m0 -99.93 -33.03 10.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.644 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -64.94 -46.72 80.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.864 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.3 mt -60.4 -39.27 80.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.603 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.596 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 39.0 ttm180 -63.78 -20.75 66.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.335 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.08 -57.56 11.61 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.778 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.66 -36.44 4.87 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.447 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -67.21 -50.86 59.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.91 0.386 . . . . 0.0 110.69 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.05 -32.77 74.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.989 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -70.8 -33.92 71.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.49 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.0 mt -99.21 -19.36 5.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.447 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 5.6 tt -59.31 -38.03 72.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -178.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.431 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -76.14 -14.01 82.69 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.512 -0.851 . . . . 0.0 112.505 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.629 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.8 OUTLIER -70.69 -15.46 62.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.558 0.218 . . . . 0.0 111.148 -179.697 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -83.02 -22.77 33.5 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.322 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 59.94 24.97 14.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.216 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -93.45 163.36 13.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.152 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.425 ' O ' HG22 ' A' ' 55' ' ' VAL . 13.4 tp10 -66.08 -35.37 80.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.98 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.8 ttm180 -64.3 -10.03 21.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.317 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.414 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -101.96 18.63 20.18 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.425 HG22 ' O ' ' A' ' 52' ' ' GLU . 20.4 m -91.8 -46.35 14.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.454 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 4.6 tp10 -59.8 -49.45 91.56 Favored Pre-proline 0 CA--C 1.531 0.216 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.0 Cg_exo -45.16 -53.08 5.7 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.993 1.795 . . . . 0.0 111.895 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.429 HD11 HD11 ' A' ' 77' ' ' LEU . 7.8 mt -57.61 -36.81 72.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.13 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 74.9 mt -63.47 -59.53 4.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.424 ' HG3' HD12 ' A' ' 61' ' ' LEU . 13.6 pttm -66.28 -37.64 85.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.795 0.331 . . . . 0.0 111.631 -178.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.704 ' HG ' HG11 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -54.48 -51.82 63.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.923 -179.456 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.481 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 75.1 mt -58.35 -15.85 12.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.876 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.04 -22.94 15.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.586 179.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -61.34 -36.17 79.44 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.089 0.471 . . . . 0.0 111.302 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.533 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 20.3 t70 57.44 28.06 14.87 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.019 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.479 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 8.0 t -73.35 -11.86 60.63 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.747 0.308 . . . . 0.0 111.116 -179.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.34 -79.01 0.51 Allowed Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.08 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.96 -39.27 69.47 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.704 HG11 ' HG ' ' A' ' 61' ' ' LEU . 17.5 t -71.79 -41.49 70.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.84 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.533 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 6.2 tmm_? -67.73 -58.54 4.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.179 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.0 m -57.75 -35.13 70.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.7 -179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -55.75 -30.29 56.23 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.72 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.28 -52.02 15.47 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -45.98 -47.41 16.66 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -70.13 -30.13 67.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.604 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.607 ' HA ' HE21 ' A' ' 79' ' ' GLN . 50.3 m -65.22 -38.64 91.04 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.429 HD11 HD11 ' A' ' 58' ' ' LEU . 8.2 mp -55.56 -59.36 4.94 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.775 0.321 . . . . 0.0 111.026 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.498 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 41.7 mt-10 -55.46 -35.96 66.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.974 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.607 HE21 ' HA ' ' A' ' 76' ' ' SER . 22.1 mt-30 -61.99 -23.63 66.54 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.559 HG23 ' HD2' ' A' ' 84' ' ' ARG . 39.8 mt -90.22 -61.72 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.444 ' N ' ' NH1' ' A' ' 84' ' ' ARG . . . 64.33 125.62 0.01 OUTLIER Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.962 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.458 ' O ' ' NH2' ' A' ' 84' ' ' ARG . . . 141.97 -169.95 25.1 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.611 -0.804 . . . . 0.0 113.149 179.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -72.91 -22.51 60.73 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.757 ' NE ' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.27 -65.38 0.68 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.187 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.757 ' H ' ' NE ' ' A' ' 84' ' ' ARG . 47.8 t -70.8 -20.52 22.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.08 0.467 . . . . 0.0 109.822 178.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.548 ' HA ' ' HE1' ' A' ' 89' ' ' MET . 2.2 tmm_? -46.25 -36.25 5.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.207 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -86.22 -27.86 24.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.705 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.19 -49.57 69.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.902 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.548 ' HE1' ' HA ' ' A' ' 86' ' ' ARG . 9.3 ptt? -58.73 -41.56 86.72 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.84 0.352 . . . . 0.0 110.294 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -63.2 -29.97 71.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.026 0.441 . . . . 0.0 109.855 178.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.438 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 10.8 tmtt? -71.06 -42.17 69.77 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.562 179.082 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.531 HD21 ' HB2' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -74.8 -24.47 58.65 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.543 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.16 -27.68 64.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.46 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -81.57 -26.58 34.85 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.619 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 74.1 p -109.67 20.91 17.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.352 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -55.41 115.59 5.96 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.027 -0.988 . . . . 0.0 113.441 -178.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.6 m -140.0 129.91 24.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.719 0.295 . . . . 0.0 110.697 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.18 -141.92 46.97 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.812 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -63.83 -25.28 68.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 111.202 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.556 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -55.63 -44.07 76.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.815 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.463 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 34.3 ttp180 -64.07 -53.77 44.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.704 0.288 . . . . 0.0 111.412 -179.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.6 tptp -50.28 -22.04 1.62 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.887 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.556 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 4.8 t -73.16 -57.58 6.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.901 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.531 ' HB2' HD21 ' A' ' 92' ' ' LEU . . . -57.32 -52.66 64.44 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 51.1 t -60.7 -45.87 96.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.504 ' N ' HD21 ' A' ' 106' ' ' ASN . 0.9 OUTLIER -70.75 -39.03 73.53 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.166 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.743 ' HH ' HH22 ' A' ' 84' ' ' ARG . 41.2 t80 -63.51 -23.92 67.59 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.163 0.506 . . . . 0.0 111.024 -178.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.519 ' HG ' ' HE3' ' A' ' 89' ' ' MET . 0.5 OUTLIER -49.98 -30.87 11.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.88 179.516 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.537 ' HG3' HG22 ' A' ' 110' ' ' THR . 12.1 pt-20 -65.12 -8.89 18.79 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' THR . . . . . 0.537 HG22 ' HG3' ' A' ' 109' ' ' GLU . 62.9 p -130.44 19.12 5.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.618 0.247 . . . . 0.0 111.42 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.2 m80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.994 179.866 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.478 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.914 0.388 . . . . 0.0 111.132 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.505 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -59.38 -50.62 73.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.652 -179.604 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.431 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -57.56 -57.36 25.83 Favored Pre-proline 0 C--N 1.325 -0.5 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.185 -179.935 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 1.1 Cg_endo -49.95 -26.39 14.12 Favored 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 121.944 1.763 . . . . 0.0 111.099 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.62 HD21 ' HA ' ' A' ' 46' ' ' ILE . 0.4 OUTLIER -73.75 -41.93 61.8 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.104 178.94 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.551 HD12 HD13 ' A' ' 31' ' ' LEU . 7.2 tp -76.84 -17.97 58.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.155 -0.93 . . . . 0.0 109.492 178.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -70.65 -32.36 69.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.619 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.3 t -65.93 -27.09 67.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.188 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.59 HD22 ' HG3' ' A' ' 39' ' ' ARG . 69.8 mt -66.52 -9.91 39.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.859 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 43.3 t -93.88 16.89 13.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.1 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -100.58 139.42 36.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.931 0.396 . . . . 0.0 111.144 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.69 -16.95 64.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.328 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -78.9 127.51 32.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.845 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -82.41 -27.39 32.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.132 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -62.96 -48.09 80.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.856 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 62.0 mt -73.07 -44.36 56.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.015 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.59 ' HG3' HD22 ' A' ' 31' ' ' LEU . 42.8 ttp180 -59.51 -27.5 66.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.821 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.83 -58.43 14.63 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.499 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.52 -42.72 67.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.673 0.273 . . . . 0.0 111.519 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.419 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.97 -56.16 24.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.856 0.36 . . . . 0.0 111.059 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.19 -31.4 71.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.256 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -69.93 -34.93 74.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.694 -0.684 . . . . 0.0 112.736 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.503 ' HA ' HD21 ' A' ' 48' ' ' ASN . 26.1 mm -98.93 -19.47 5.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.858 0.361 . . . . 0.0 111.843 -178.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.62 ' HA ' HD21 ' A' ' 27' ' ' LEU . 5.8 tt -57.23 -36.63 52.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.932 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.58 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -76.69 -12.55 84.36 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.457 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.503 HD21 ' HA ' ' A' ' 45' ' ' ILE . 21.4 m-80 -68.77 -21.17 64.37 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -83.85 -36.22 23.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.62 0.248 . . . . 0.0 111.249 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.533 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.8 OUTLIER 68.38 55.81 0.5 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.123 179.735 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.429 ' O ' HG21 ' A' ' 55' ' ' VAL . 7.5 m-20 -127.79 -178.28 4.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.02 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.36 -38.44 91.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.954 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -65.7 -12.08 50.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.052 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.9 7.51 32.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.051 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.429 HG21 ' O ' ' A' ' 51' ' ' ASP . 86.1 t -91.37 -59.28 3.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.412 -178.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.422 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 22.5 tt0 -60.09 -49.4 91.17 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.422 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 83.1 Cg_exo -42.56 -52.78 4.2 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.334 2.023 . . . . 0.0 112.86 -179.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.508 HD22 ' HA ' ' A' ' 73' ' ' ALA . 12.0 mt -59.81 -34.76 73.47 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.741 -179.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.4 HG12 ' O ' ' A' ' 55' ' ' VAL . 51.3 mm -63.44 -59.89 3.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.83 -6.37 37.44 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.622 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -89.42 -37.13 15.04 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.478 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.611 HD13 HD21 ' A' ' 92' ' ' LEU . 5.9 mt -62.97 -9.64 10.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.492 . . . . 0.0 110.651 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -112.48 -12.61 13.47 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.995 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.42 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.0 t0 -61.03 -30.05 70.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.256 0.55 . . . . 0.0 110.668 179.659 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.442 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 38.5 m-20 48.58 30.62 2.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.698 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.49 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 18.4 t -83.82 -5.66 59.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.717 0.294 . . . . 0.0 111.118 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.12 -80.55 1.2 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.279 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -67.52 -43.8 79.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.123 0.487 . . . . 0.0 109.824 179.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.622 HG12 ' HG ' ' A' ' 61' ' ' LEU . 42.3 t -73.45 -38.53 53.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.576 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.442 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 4.8 tmm_? -72.55 -62.62 1.38 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.09 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.2 t -51.99 -27.76 14.55 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.865 0.364 . . . . 0.0 110.813 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.49 -45.76 95.02 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.097 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.508 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -59.89 -45.26 93.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.945 0.402 . . . . 0.0 110.49 179.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.84 -24.68 67.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.571 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 ttt85 -83.64 -39.01 20.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.333 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.58 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 51.5 m -66.66 -35.82 81.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.01 -179.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 73' ' ' ALA . 77.7 mt -55.5 -60.12 3.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.737 0.303 . . . . 0.0 111.226 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -53.98 -29.38 42.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.952 0.406 . . . . 0.0 110.289 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.433 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 48.1 mt-30 -70.41 -38.76 74.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.292 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.533 HG12 ' HG3' ' A' ' 50' ' ' GLN . 67.8 mt -75.89 -61.08 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.149 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.472 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 57.99 110.64 0.01 OUTLIER Glycine 0 C--N 1.332 0.312 0 C-N-CA 121.154 -0.546 . . . . 0.0 113.207 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.95 -171.36 37.0 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.769 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -62.56 -40.35 96.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.844 0.354 . . . . 0.0 110.632 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.412 ' HD2' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -58.48 -43.81 89.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.448 179.81 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.472 HG21 ' N ' ' A' ' 81' ' ' GLY . 2.2 t -70.94 -27.58 30.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.589 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -31.44 62.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.804 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.52 -19.62 30.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.818 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.87 -50.94 53.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.572 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -28.64 63.35 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.815 0.341 . . . . 0.0 110.883 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -69.59 -33.03 72.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.801 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -80.66 -25.4 38.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.088 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.611 HD21 HD13 ' A' ' 62' ' ' LEU . 3.9 tp -86.71 -31.27 21.1 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.93 -26.48 62.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.713 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -79.97 -29.1 39.52 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 36.3 p -110.59 25.88 11.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.982 178.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.508 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -47.14 108.64 0.31 Allowed Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.62 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.5 p -142.7 130.51 21.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.924 0.393 . . . . 0.0 111.241 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.58 -141.37 47.72 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.084 -0.579 . . . . 0.0 113.349 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -68.35 -27.26 66.1 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 122.465 0.306 . . . . 0.0 111.68 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.584 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -54.52 -47.71 72.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.878 0.37 . . . . 0.0 111.738 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.508 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 45.9 ttp180 -56.41 -59.97 4.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.802 -179.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -45.57 -25.76 0.5 Allowed 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.953 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.584 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 52.6 t -74.68 -56.51 8.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.608 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.596 ' HB1' HD23 ' A' ' 92' ' ' LEU . . . -53.84 -47.25 71.14 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.512 ' HA ' HD13 ' A' ' 108' ' ' LEU . 48.8 t -65.48 -55.52 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -62.72 -43.74 98.03 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.407 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 31.0 t80 -60.51 -27.56 67.7 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 120.889 0.376 . . . . 0.0 111.527 -178.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.512 HD13 ' HA ' ' A' ' 105' ' ' VAL . 9.9 mt -56.58 -21.51 27.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.537 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -77.06 4.43 10.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.582 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 5.2 m -111.38 -75.76 0.61 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.749 0.309 . . . . 0.0 111.051 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.819 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.495 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.579 0.228 . . . . 0.0 111.39 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.513 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.2 t80 -63.34 -46.91 84.43 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.841 0.353 . . . . 0.0 110.316 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' A' ' 27' ' ' LEU . 37.1 mt-10 -43.34 -54.24 10.04 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 53.7 Cg_exo -35.99 -31.05 0.08 OUTLIER 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.515 2.143 . . . . 0.0 112.011 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.513 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 75.2 mt -71.71 -57.55 4.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.132 178.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.475 HD23 HD13 ' A' ' 31' ' ' LEU . 3.4 tm? -55.5 -39.66 70.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.726 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -62.75 -29.37 70.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.336 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 29.1 t -64.53 -20.42 66.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.428 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.597 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 59.5 mt -69.63 -11.74 61.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.805 0.336 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.2 m -101.99 14.61 31.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.004 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -94.05 139.51 30.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.883 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -63.22 -17.9 62.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.8 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -77.2 155.68 32.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.139 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -110.83 -39.31 4.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.667 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -60.03 -34.24 73.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.976 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.1 mt -82.61 -42.98 18.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.265 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.597 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 40.6 ttm180 -58.66 -47.54 84.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.395 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.03 -56.23 26.3 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.687 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.36 -33.76 21.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.772 0.32 . . . . 0.0 111.224 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.81 -47.48 84.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.567 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -76.6 -23.69 53.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.156 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.2 m95 -61.13 -38.39 86.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.011 0.434 . . . . 0.0 110.588 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.0 mm -99.86 -18.71 6.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.267 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.567 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -50.09 -44.61 22.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.17 -178.882 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.419 ' N ' ' CG2' ' A' ' 46' ' ' ILE . . . -72.53 -14.68 77.48 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.617 -0.801 . . . . 0.0 113.04 -179.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -70.69 -10.6 59.78 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.552 0.205 . . . . 0.0 111.552 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -92.75 -26.05 17.92 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.611 ' HG3' HG12 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 62.51 51.03 3.38 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.942 0.401 . . . . 0.0 111.123 -179.849 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -127.17 171.28 11.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.99 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.75 -36.56 83.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.794 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -66.61 -9.61 37.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.771 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.503 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -100.99 3.86 41.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.648 -179.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 47.6 t -92.06 -53.23 9.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.246 -179.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.536 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 12.7 tt0 -60.15 -51.21 81.98 Favored Pre-proline 0 CA--C 1.533 0.289 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -178.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 82.8 Cg_exo -46.58 -37.31 20.08 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.332 2.021 . . . . 0.0 112.649 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.456 HD11 HD12 ' A' ' 77' ' ' LEU . 48.9 mt -65.77 -40.55 92.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.065 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.452 HD13 ' HA ' ' A' ' 88' ' ' ALA . 46.7 mm -52.77 -54.38 16.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.294 -0.412 . . . . 0.0 112.08 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.82 74.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.042 -178.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.683 HD23 ' H ' ' A' ' 73' ' ' ALA . 0.3 OUTLIER -64.52 -37.54 87.91 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.284 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.518 ' HB3' HD22 ' A' ' 92' ' ' LEU . 34.9 mt -59.72 -13.73 11.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.306 0.574 . . . . 0.0 110.104 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -112.51 -13.43 13.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.241 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.471 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.6 OUTLIER -61.25 93.99 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.759 179.639 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -75.04 33.95 0.1 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.083 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.454 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 10.8 t -79.36 -27.11 41.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.972 0.415 . . . . 0.0 110.404 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.74 -110.12 1.13 Allowed Glycine 0 N--CA 1.453 -0.186 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.097 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -54.68 -25.46 27.31 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.535 HG13 ' HG ' ' A' ' 61' ' ' LEU . 41.3 t -64.72 -47.28 89.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.047 178.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -54.58 -54.44 41.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.948 0.404 . . . . 0.0 110.423 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 80.7 p -67.24 -16.59 64.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.071 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.548 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -52.53 -67.55 2.02 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.519 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.683 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -59.24 -36.51 75.6 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.538 0.209 . . . . 0.0 111.173 179.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -45.35 -56.38 5.01 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.574 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 72' ' ' GLY . 0.0 OUTLIER -70.2 -26.73 64.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.144 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.583 ' HA ' HE21 ' A' ' 79' ' ' GLN . 51.8 m -64.77 -39.27 93.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.74 0.305 . . . . 0.0 111.032 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.456 HD12 HD11 ' A' ' 58' ' ' LEU . 4.8 mp -61.08 -60.45 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.873 0.368 . . . . 0.0 110.55 179.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -57.21 -19.93 23.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.636 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.583 HE21 ' HA ' ' A' ' 76' ' ' SER . 3.3 tt0 -68.08 -56.99 6.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.432 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.611 HG12 ' HG3' ' A' ' 50' ' ' GLN . 82.7 mt -64.99 -60.59 2.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.143 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.12 102.37 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.451 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 174.83 -174.6 46.76 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.673 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -68.5 -37.03 79.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.872 0.368 . . . . 0.0 110.88 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.499 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.91 -46.19 90.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.528 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.608 HG22 ' HB ' ' A' ' 80' ' ' ILE . 21.3 t -70.88 -25.14 25.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.147 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -58.42 -35.01 71.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.55 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.33 -21.85 48.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.386 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.452 ' HA ' HD13 ' A' ' 59' ' ' ILE . . . -71.4 -41.86 69.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.287 179.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.492 ' HE1' HD21 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -72.26 -35.0 68.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.136 179.6 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -60.43 -44.88 95.33 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.513 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 3.8 tmtp? -62.34 -32.53 73.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.838 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.518 HD22 ' HB3' ' A' ' 62' ' ' LEU . 0.6 OUTLIER -83.06 -25.48 32.04 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.73 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.01 -18.92 64.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.332 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -80.3 -31.04 38.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.873 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.4 p -115.83 22.13 13.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.56 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.445 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.27 119.09 11.78 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.255 -0.884 . . . . 0.0 113.339 -178.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 26.0 m -143.83 129.11 18.83 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.744 0.306 . . . . 0.0 110.804 178.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.24 -136.34 51.05 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.861 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.417 ' O ' HG23 ' A' ' 103' ' ' VAL . 64.3 t80 -60.86 -38.01 84.1 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.797 0.332 . . . . 0.0 110.711 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.457 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -50.71 -41.59 56.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.879 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.445 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 38.6 ttt180 -68.91 -59.54 2.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.793 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -46.29 -23.97 0.42 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.917 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.448 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.9 t -66.16 -60.31 2.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.276 179.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.48 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -58.48 -52.0 67.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.968 0.413 . . . . 0.0 111.774 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 61.7 t -57.69 -61.72 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.496 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -58.62 -30.06 66.98 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -59.71 -27.05 66.12 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.017 0.437 . . . . 0.0 110.49 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.492 HD21 ' HE1' ' A' ' 89' ' ' MET . 18.2 mt -59.99 -29.3 68.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.448 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -52.45 -25.75 10.91 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.152 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.8 p -101.91 -50.67 3.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.037 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.896 -179.817 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.505 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 121.089 0.471 . . . . 0.0 110.164 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 3.0 t80 -63.35 -46.45 86.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.925 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.436 ' O ' ' N ' ' A' ' 27' ' ' LEU . 6.4 mm-40 -63.4 -51.95 64.1 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.675 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.505 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 95.8 Cg_exo -42.93 -19.12 0.12 Allowed 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 122.427 2.085 . . . . 0.0 111.926 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.2 mt -85.66 -52.39 5.83 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.159 178.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.483 HD12 HD13 ' A' ' 31' ' ' LEU . 52.5 tp -59.29 -33.65 71.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.728 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.99 -28.42 69.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.843 0.354 . . . . 0.0 110.745 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.8 t -63.69 -21.39 66.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.516 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.618 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 42.0 mt -67.5 -6.74 21.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.696 0.284 . . . . 0.0 111.047 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 91.5 p -113.94 20.45 15.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.318 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.04 150.42 21.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.87 0.367 . . . . 0.0 111.184 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.95 -29.18 69.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.048 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -78.29 160.69 27.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.926 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.9 p90 -111.15 -39.6 4.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.177 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -59.68 -34.65 73.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.933 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.7 mt -76.86 -42.52 33.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.683 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.618 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 27.5 ttm180 -54.16 -32.18 54.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.71 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.4 -47.07 65.19 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.232 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.3 -24.81 12.63 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.759 0.314 . . . . 0.0 111.138 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.406 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -68.58 -57.42 5.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.388 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.82 -17.5 62.15 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.24 0.543 . . . . 0.0 110.582 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -46.79 87.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.183 -179.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.407 ' HA ' HD21 ' A' ' 48' ' ' ASN . 12.6 mt -98.53 -24.32 4.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.406 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 5.1 tt -56.44 -24.59 19.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.685 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.44 -27.43 65.63 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.905 -179.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.407 HD21 ' HA ' ' A' ' 45' ' ' ILE . 43.5 m-80 -59.84 -22.31 62.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.646 0.26 . . . . 0.0 111.471 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -105.07 107.73 18.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.425 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.634 ' HG3' HG21 ' A' ' 80' ' ' ILE . 1.4 mp0 -65.91 78.87 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.139 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -127.61 153.86 45.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.514 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.402 ' O ' HG21 ' A' ' 55' ' ' VAL . 13.5 pt-20 -64.91 -28.44 69.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.443 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -69.33 -12.12 61.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.363 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.421 ' HB3' ' HZ ' ' A' ' 24' ' ' PHE . . . -104.37 21.94 15.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.406 ' CG2' ' N ' ' A' ' 56' ' ' GLU . 32.7 m -91.75 -57.88 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.717 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 28.7 tt0 -60.31 -50.52 85.47 Favored Pre-proline 0 CA--C 1.533 0.319 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.484 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 95.1 Cg_exo -40.37 -52.03 3.15 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.495 2.13 . . . . 0.0 112.99 -179.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' A' ' 62' ' ' LEU . 4.1 mt -62.97 -46.67 86.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.717 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.6 mm -56.82 -56.24 15.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -179.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -70.09 -16.99 63.2 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.686 ' HG ' HG11 ' A' ' 69' ' ' VAL . 11.4 tp -90.47 -40.7 11.86 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -177.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.483 HD11 ' HG3' ' A' ' 63' ' ' GLU . 2.9 pp -64.6 -9.76 21.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.76 0.314 . . . . 0.0 111.657 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.483 ' HG3' HD11 ' A' ' 62' ' ' LEU . 24.0 mt-10 -98.81 -11.87 21.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.553 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.4 ' HB3' ' CG1' ' A' ' 69' ' ' VAL . 7.0 t70 -62.58 -30.64 71.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.175 0.512 . . . . 0.0 111.339 -179.077 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.665 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 12.3 m-20 63.6 23.94 13.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.935 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.8 t -83.68 1.37 42.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.603 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.551 ' H ' ' HG2' ' A' ' 70' ' ' ARG . . . 84.8 -94.17 1.86 Allowed Glycine 0 C--O 1.227 -0.311 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.671 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -49.33 -44.88 44.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.41 0.624 . . . . 0.0 110.066 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.686 HG11 ' HG ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -63.4 -44.76 99.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.076 -0.966 . . . . 0.0 112.271 -178.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.665 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 13.6 ptt180 -78.44 -22.48 47.56 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.426 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 67.6 m -66.85 -52.11 47.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.588 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -52.73 -47.73 57.9 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.013 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.469 ' HA ' ' HG ' ' A' ' 76' ' ' SER . . . -56.56 -39.27 73.17 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.019 0.438 . . . . 0.0 110.882 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.463 ' HA ' HG11 ' A' ' 103' ' ' VAL . . . -61.87 -54.2 45.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.782 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 71' ' ' SER . 6.6 ptp180 -70.99 -27.26 63.57 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.469 ' HG ' ' HA ' ' A' ' 73' ' ' ALA . 32.0 p -63.33 -40.04 96.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.454 0.169 . . . . 0.0 111.449 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 93.1 mt -61.43 -59.83 4.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.719 0.295 . . . . 0.0 110.572 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -55.16 -25.73 34.1 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.095 0.474 . . . . 0.0 110.052 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.407 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 4.3 mt-30 -69.46 -45.0 70.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.223 179.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.634 HG21 ' HG3' ' A' ' 50' ' ' GLN . 90.4 mt -64.16 -61.13 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.712 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.46 124.53 0.01 OUTLIER Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.008 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 150.65 165.17 12.48 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.914 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -58.13 -22.27 50.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.863 0.363 . . . . 0.0 110.76 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.554 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -74.06 -36.67 64.37 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.895 -179.693 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.554 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 13.7 t -70.77 -28.59 34.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.013 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 86' ' ' ARG . 18.1 tpt85 -51.39 -29.52 15.96 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.215 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.12 -31.21 23.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.098 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.47 -56.66 12.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.592 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.573 ' HE2' ' HB1' ' A' ' 104' ' ' ALA . 3.2 ppp? -64.21 -24.87 67.83 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.563 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.433 ' N ' ' SD ' ' A' ' 89' ' ' MET . 6.0 mm-40 -68.8 -31.22 70.07 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.424 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 1.8 tmtp? -71.53 -37.24 71.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.358 179.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.477 HD13 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -82.2 -26.87 32.97 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.63 -26.32 66.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.192 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -80.17 -26.81 39.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.719 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.8 p -109.96 19.24 19.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.576 178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.518 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -52.93 111.71 1.82 Allowed Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.276 -0.874 . . . . 0.0 113.101 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.2 t -142.85 130.85 21.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.838 0.352 . . . . 0.0 110.873 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.44 -126.6 35.89 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.729 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -80.58 -29.84 36.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.882 0.372 . . . . 0.0 110.855 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.459 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -51.57 -34.7 38.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.677 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.518 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 42.4 ttt180 -72.04 -56.68 5.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.738 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -45.95 -23.15 0.26 Allowed 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.769 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.463 HG11 ' HA ' ' A' ' 74' ' ' ALA . 53.9 t -69.92 -57.66 7.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.593 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.573 ' HB1' ' HE2' ' A' ' 89' ' ' MET . . . -59.47 -55.27 36.75 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -178.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.428 HG13 ' N ' ' A' ' 106' ' ' ASN . 7.0 p -62.64 -55.72 22.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.428 ' N ' HG13 ' A' ' 105' ' ' VAL . 27.1 t-20 -56.95 -31.23 64.77 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -178.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.411 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 7.0 t80 -60.4 -33.4 72.43 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.103 0.478 . . . . 0.0 110.635 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -54.38 -13.3 0.87 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.788 -179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -54.2 -20.68 7.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.202 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.6 p -110.82 -69.64 0.86 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.351 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 60.9 m80 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.92 -179.929 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.463 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 120.832 0.349 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.442 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 3.8 t80 -61.62 -42.15 98.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.016 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -59.4 -54.55 54.94 Favored Pre-proline 0 C--N 1.33 -0.279 0 C-N-CA 120.629 -0.429 . . . . 0.0 111.384 -179.585 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.463 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 52.2 Cg_exo -48.28 -26.39 8.28 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.886 1.724 . . . . 0.0 110.86 178.714 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.463 HD22 HG13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -80.14 -36.41 35.26 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.618 179.472 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.596 HD12 HD13 ' A' ' 31' ' ' LEU . 9.4 tp -76.99 -24.61 52.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.446 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -68.94 -42.66 76.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.897 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.6 m -66.56 -12.87 59.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.569 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.596 HD13 HD12 ' A' ' 28' ' ' LEU . 81.1 mt -68.9 -7.16 32.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.687 0.28 . . . . 0.0 111.252 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.2 p -110.16 8.04 23.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.035 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.491 HD22 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -67.58 150.32 48.95 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.923 -179.839 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -64.12 -31.16 72.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.325 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.27 152.27 36.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.075 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 13.4 p90 -100.61 -33.33 10.35 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.161 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -58.79 -50.91 72.18 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.428 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.447 ' HB ' ' OD1' ' A' ' 33' ' ' ASN . 77.8 mt -63.22 -39.76 86.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.368 179.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.507 ' CZ ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -62.3 -23.47 66.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.158 179.504 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.09 -59.61 4.57 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.032 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.6 -36.17 4.54 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.829 0.347 . . . . 0.0 110.78 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.53 -48.97 79.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.261 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.42 ' HB3' HD21 ' A' ' 61' ' ' LEU . . . -66.19 -30.64 71.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.042 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.0 m95 -68.31 -32.44 72.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.506 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.5 mt -98.93 -19.88 5.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.784 0.326 . . . . 0.0 111.528 -179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.463 HG13 HD22 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -60.35 -40.25 83.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.866 -178.908 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.07 -23.35 78.11 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.639 -0.791 . . . . 0.0 113.078 -179.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -70.75 2.08 4.62 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -101.22 -28.15 12.82 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.539 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.434 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.3 OUTLIER 57.26 31.48 20.17 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.117 0.484 . . . . 0.0 110.897 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -102.55 162.69 12.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.137 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.413 ' HA ' HG21 ' A' ' 55' ' ' VAL . 10.4 pt-20 -61.76 -33.49 74.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 110.574 179.714 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.445 ' NE ' HD22 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -68.24 -16.68 64.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.354 179.721 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -96.75 -5.83 37.66 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.664 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.413 HG21 ' HA ' ' A' ' 52' ' ' GLU . 94.2 t -76.15 -46.29 34.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.535 -179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.514 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 34.6 tt0 -60.37 -50.4 85.97 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.514 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 95.0 Cg_exo -44.15 -53.85 4.38 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.549 2.166 . . . . 0.0 113.016 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.585 HD13 HD21 ' A' ' 77' ' ' LEU . 9.6 mt -54.5 -37.64 65.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.442 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.1 mm -59.67 -61.04 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -70.62 -12.21 61.42 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.608 ' HG ' HG11 ' A' ' 69' ' ' VAL . 1.5 mp -89.39 -41.53 12.06 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -177.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.6 HD12 HD22 ' A' ' 77' ' ' LEU . 12.3 mt -64.49 -9.89 21.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.115 0.483 . . . . 0.0 110.997 -178.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -116.18 -12.11 11.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.703 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.415 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -61.27 -32.91 72.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.346 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.558 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 17.8 m-20 59.13 29.35 18.89 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.301 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.45 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 11.8 m -79.81 10.09 4.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.728 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 67.84 -82.29 0.17 Allowed Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.427 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -48.79 78.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.021 0.438 . . . . 0.0 110.156 179.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.608 HG11 ' HG ' ' A' ' 61' ' ' LEU . 2.1 t -72.67 -44.26 60.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.675 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.558 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 3.7 tmm_? -59.03 -48.34 81.96 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.849 0.357 . . . . 0.0 110.444 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 72.7 m -67.1 -36.77 82.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.787 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.05 -30.0 60.07 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.676 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.462 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -80.73 -40.23 25.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.646 0.26 . . . . 0.0 110.846 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.531 ' HA ' HG12 ' A' ' 103' ' ' VAL . . . -49.83 -45.36 50.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.732 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 3.7 ptp85 -72.24 -25.61 61.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.579 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.416 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 41.9 m -67.19 -35.54 79.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.763 -179.397 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.6 HD22 HD12 ' A' ' 62' ' ' LEU . 4.0 mm? -55.55 -59.95 4.11 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.837 0.351 . . . . 0.0 110.724 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -64.18 -25.76 68.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.968 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.416 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 11.8 mt-30 -61.54 -43.98 97.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.212 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.434 HG12 ' HG3' ' A' ' 50' ' ' GLN . 64.8 mt -70.22 -60.86 2.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.271 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.417 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 66.59 108.37 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.788 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.489 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 152.29 -176.26 30.62 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.653 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -71.55 -31.85 67.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.339 . . . . 0.0 110.971 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.577 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.09 -54.03 49.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.577 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 9.3 p -70.65 -24.42 25.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.135 0.493 . . . . 0.0 110.816 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -57.31 -26.82 61.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.118 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.27 -26.93 47.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.987 0.422 . . . . 0.0 110.674 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.25 -46.56 60.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.305 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.499 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.92 -33.66 70.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.867 0.365 . . . . 0.0 110.566 179.837 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.4 -41.34 98.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.428 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -70.72 -24.49 62.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.025 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.454 HD22 ' O ' ' A' ' 100' ' ' ALA . 0.3 OUTLIER -84.86 -30.08 24.76 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.08 67.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.619 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.33 -25.78 39.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.343 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.3 p -117.1 21.39 13.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.33 179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.426 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.52 119.77 15.31 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 114.946 -1.024 . . . . 0.0 113.46 -178.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 29.8 m -139.76 129.87 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.556 -0.322 . . . . 0.0 110.361 179.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.73 -143.47 48.65 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.757 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -63.9 -30.34 71.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.756 0.312 . . . . 0.0 111.527 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.454 ' O ' HD22 ' A' ' 92' ' ' LEU . . . -54.15 -34.38 60.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.117 -179.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.426 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 60.3 ttt180 -70.86 -58.95 3.09 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.573 ' HG3' ' ND2' ' A' ' 106' ' ' ASN . 20.9 ttmm -45.84 -25.45 0.52 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.171 0.51 . . . . 0.0 111.082 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.531 HG12 ' HA ' ' A' ' 74' ' ' ALA . 37.7 t -67.41 -48.29 77.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.375 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.499 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -64.85 -59.31 4.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.567 0.699 . . . . 0.0 112.251 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.447 HG21 ' H ' ' A' ' 106' ' ' ASN . 0.0 OUTLIER -59.39 -63.01 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 114.731 -1.122 . . . . 0.0 113.973 -177.955 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.573 ' ND2' ' HG3' ' A' ' 102' ' ' LYS . 16.0 m-80 -55.53 -25.59 38.37 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.417 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 2.1 t80 -59.0 -35.85 73.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.039 0.447 . . . . 0.0 109.927 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.495 HD23 ' HE1' ' A' ' 89' ' ' MET . 46.3 mt -52.57 -22.53 5.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.717 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -64.25 -6.29 6.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.541 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.2 m -117.12 -47.6 2.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.742 0.306 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 85.8 m-70 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.93 179.701 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.457 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.175 0 CA-C-O 120.693 0.283 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -61.87 -48.76 79.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.595 179.582 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.4 -55.29 36.76 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.735 179.644 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 40.4 Cg_exo -50.56 -21.33 7.54 Favored 'Trans proline' 0 C--N 1.359 1.106 0 C-N-CA 121.838 1.692 . . . . 0.0 110.432 179.058 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.605 HD22 ' HA ' ' A' ' 46' ' ' ILE . 1.3 tp -86.32 -38.11 17.82 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.138 -1.392 . . . . 0.0 109.966 179.768 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.569 HD13 HD13 ' A' ' 31' ' ' LEU . 15.1 tp -74.58 -21.89 59.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.41 179.208 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.53 -35.23 75.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.878 -179.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.0 m -63.71 -24.48 67.79 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.514 -179.665 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.569 HD13 HD13 ' A' ' 28' ' ' LEU . 90.1 mt -67.46 -16.59 64.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.12 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.4 m -100.27 12.16 37.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.793 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -85.36 144.19 28.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.057 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -67.53 -29.42 68.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.035 -179.921 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -75.93 144.92 40.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.055 -179.831 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.502 ' HB2' HG22 ' A' ' 69' ' ' VAL . 58.1 p-90 -89.39 -31.93 17.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.748 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.4 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 4.9 tmt_? -58.96 -35.43 73.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.654 179.616 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 mm -82.74 -47.02 18.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.542 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.5 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 51.3 ttp180 -57.43 -42.07 81.67 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.772 -179.273 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -55.95 -63.08 5.62 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.739 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.7 -25.98 0.84 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.65 0.262 . . . . 0.0 111.596 -179.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.424 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -64.11 -57.0 10.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.794 0.33 . . . . 0.0 110.397 179.529 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.95 -24.95 68.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.499 179.475 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.426 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 8.1 m95 -61.2 -44.91 96.54 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.154 -179.489 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.435 ' HA ' HD21 ' A' ' 48' ' ' ASN . 27.8 mm -98.78 -19.05 6.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -178.886 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.605 ' HA ' HD22 ' A' ' 27' ' ' LEU . 5.8 tt -56.43 -34.25 40.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -178.499 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.42 -19.02 79.73 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.567 -0.825 . . . . 0.0 113.184 -179.277 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.435 HD21 ' HA ' ' A' ' 45' ' ' ILE . 28.9 m-80 -70.87 2.39 4.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.376 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -107.06 -18.43 13.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -179.545 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.553 ' HG3' HG12 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 55.97 56.54 5.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.807 0.336 . . . . 0.0 111.249 -179.679 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -127.61 161.16 29.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.023 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.405 ' HA ' HG22 ' A' ' 55' ' ' VAL . 13.1 pt-20 -65.86 -30.6 71.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.692 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.504 ' HD3' HD23 ' A' ' 28' ' ' LEU . 17.2 ttm180 -69.17 -10.89 59.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.69 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.3 3.17 27.34 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.066 -179.557 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.543 HG23 HH12 ' A' ' 84' ' ' ARG . 64.5 t -83.2 -55.09 7.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.173 -178.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.468 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 18.9 tt0 -59.17 -49.01 95.26 Favored Pre-proline 0 CA--C 1.532 0.271 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.69 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 90.4 Cg_exo -42.94 -32.33 2.63 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.484 2.123 . . . . 0.0 112.732 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.608 ' HA ' ' HB2' ' A' ' 73' ' ' ALA . 4.8 mt -73.35 -52.71 12.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.736 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 38.5 mm -49.25 -50.75 15.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.968 -179.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.99 -32.85 71.26 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -178.629 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.498 ' HG ' HG12 ' A' ' 69' ' ' VAL . 5.2 tp -89.82 -12.41 39.21 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.895 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.536 HD22 ' HA ' ' A' ' 74' ' ' ALA . 17.0 mt -72.97 -13.84 61.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.881 0.372 . . . . 0.0 111.1 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -116.03 9.78 14.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.101 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.07 -31.75 71.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.265 0.555 . . . . 0.0 110.931 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 23.3 m-20 51.9 25.14 2.88 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.237 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.466 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.9 t -86.22 -17.15 35.54 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.758 0.314 . . . . 0.0 110.825 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.76 -110.22 1.6 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.311 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.426 ' HD1' ' NE1' ' A' ' 44' ' ' TRP . 0.1 OUTLIER -60.33 -26.58 66.68 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.469 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.502 HG22 ' HB2' ' A' ' 36' ' ' TRP . 24.3 t -69.46 -30.04 44.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.628 178.685 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.463 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 57.5 ttp180 -78.38 -55.74 5.0 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.464 179.391 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.46 ' O ' ' HG3' ' A' ' 75' ' ' ARG . 46.2 m -62.37 -28.0 69.47 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.967 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.5 -59.98 9.79 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.583 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.608 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . . . -60.68 -27.94 68.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.786 0.327 . . . . 0.0 110.911 179.984 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.536 ' HA ' HD22 ' A' ' 62' ' ' LEU . . . -61.9 -45.15 95.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.573 -179.775 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.505 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 28.5 mtp85 -62.2 -33.47 74.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.412 -179.578 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.8 m -50.74 -46.48 59.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.846 -178.358 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.437 HD13 ' H ' ' A' ' 77' ' ' LEU . 5.7 mp -56.96 -55.76 30.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.844 0.354 . . . . 0.0 110.133 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -59.1 -32.76 70.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.281 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 29.6 mt-30 -65.32 -30.74 71.62 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.803 0.335 . . . . 0.0 110.776 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.553 HG12 ' HG3' ' A' ' 50' ' ' GLN . 90.1 mt -90.06 -60.88 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.3 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.51 113.66 0.01 OUTLIER Glycine 0 C--N 1.331 0.27 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.016 179.754 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.402 ' H ' ' HB2' ' A' ' 111' ' ' HIS . . . 160.03 174.89 30.39 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.629 179.851 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.3 -32.77 74.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.809 0.338 . . . . 0.0 111.004 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.586 HH11 HG11 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -61.48 -54.85 37.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.469 179.948 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.586 HG11 HH11 ' A' ' 84' ' ' ARG . 0.0 OUTLIER -70.72 -21.62 22.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.834 179.213 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -56.44 -27.79 57.68 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.712 179.921 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.62 -27.55 45.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.241 179.69 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.69 -47.08 79.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.666 179.497 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.618 ' HE1' ' HB1' ' A' ' 104' ' ' ALA . 3.0 ppp? -67.57 -25.91 66.02 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.76 0.314 . . . . 0.0 110.215 179.735 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.442 ' N ' ' SD ' ' A' ' 89' ' ' MET . 37.0 mt-10 -69.03 -39.27 79.32 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.707 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -69.46 -31.2 69.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.908 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.415 ' O ' ' N ' ' A' ' 96' ' ' GLY . 0.5 OUTLIER -85.73 -24.29 26.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.096 -179.945 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.99 -28.76 70.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.68 179.391 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -80.34 -25.01 39.46 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.048 0.451 . . . . 0.0 110.011 179.627 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.0 p -111.99 17.48 19.63 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.393 179.215 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.424 ' HA3' ' CD ' ' A' ' 101' ' ' ARG . . . -55.76 121.5 23.4 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.887 -179.346 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.6 t -139.81 130.11 25.32 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.432 -0.384 . . . . 0.0 111.267 179.455 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 51.58 -113.23 2.24 Favored Glycine 0 C--N 1.33 0.215 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.743 179.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -78.71 -33.32 46.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.756 0.312 . . . . 0.0 110.91 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.471 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.57 -39.46 64.83 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.61 -179.929 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.424 ' CD ' ' HA3' ' A' ' 96' ' ' GLY . 8.5 tpt180 -66.66 -61.28 2.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.677 0.275 . . . . 0.0 111.341 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -48.26 -26.78 2.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.884 -179.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 8.5 t -61.13 -52.7 58.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.022 179.53 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.618 ' HB1' ' HE1' ' A' ' 89' ' ' MET . . . -64.84 -59.81 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.124 -179.475 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 52.1 t -52.58 -63.03 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.934 -178.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -56.03 -33.94 65.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -178.844 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -61.08 -25.57 67.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.028 0.442 . . . . 0.0 111.067 -179.398 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.439 ' HG ' ' HE3' ' A' ' 89' ' ' MET . 81.1 mt -57.89 -21.53 43.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.735 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -96.29 7.04 47.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.77 -179.16 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 66.8 p -119.97 -16.46 8.63 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -179.125 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.406 ' HD2' ' HA ' ' A' ' 108' ' ' LEU . 7.9 p80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.066 -0.969 . . . . 0.0 110.81 -179.746 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.402 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.622 0.248 . . . . 0.0 111.582 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.594 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.2 t80 -63.26 -44.64 94.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.038 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.35 -56.17 29.49 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.402 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 89.5 Cg_exo -45.15 -26.85 2.5 Favored 'Trans proline' 0 C--N 1.358 1.052 0 C-N-CA 122.022 1.815 . . . . 0.0 111.269 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.3 mt -71.21 -55.92 7.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.142 -0.936 . . . . 0.0 109.51 178.3 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.461 HD11 HD13 ' A' ' 31' ' ' LEU . 14.8 tp -63.64 -18.49 64.0 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.95 178.814 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -82.91 -30.17 28.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.66 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.453 ' OG ' HG21 ' A' ' 38' ' ' ILE . 44.2 t -65.09 -17.16 64.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.995 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.648 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 89.1 mt -66.28 -20.88 66.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.941 179.978 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.2 m -89.78 19.17 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.605 179.502 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -101.48 131.6 47.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.053 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -66.87 -11.32 55.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.469 -179.658 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -86.38 133.42 33.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.903 0.383 . . . . 0.0 111.329 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 53.8 p-90 -79.03 -32.1 44.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.366 179.423 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -64.97 -50.43 66.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.14 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.453 HG21 ' OG ' ' A' ' 30' ' ' SER . 71.5 mt -66.94 -51.7 51.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.228 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.648 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 32.1 ttm180 -58.59 -24.62 61.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.815 0.341 . . . . 0.0 110.707 -179.944 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.27 -57.55 7.43 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.48 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.17 -37.86 36.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.658 0.266 . . . . 0.0 111.415 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.63 -52.69 64.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.911 0.386 . . . . 0.0 110.758 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.55 76.05 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.12 179.588 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -66.3 -28.92 69.06 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.432 -178.827 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 53.5 mt -100.09 -27.14 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.849 0.357 . . . . 0.0 111.567 -179.026 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.431 HD13 ' HB3' ' A' ' 27' ' ' LEU . 1.1 tt -58.39 -30.95 41.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.023 -178.943 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -68.38 -21.24 74.12 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.513 -179.299 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -70.57 -25.21 62.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.888 0.344 . . . . 0.0 111.9 -179.318 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -69.68 -35.22 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -179.45 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.606 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 41.3 mt-30 64.99 17.62 11.16 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.058 0.456 . . . . 0.0 110.354 -179.964 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -89.56 164.08 14.93 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.236 -179.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -62.9 -36.74 84.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.079 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -68.23 -9.21 45.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.712 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.6 -1.77 29.67 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.479 -179.615 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.6 t -87.57 -35.08 7.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.15 -179.761 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.522 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.6 tm-20 -60.41 -49.6 89.58 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.504 -179.679 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 71.7 Cg_exo -48.19 -50.48 11.94 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.041 1.827 . . . . 0.0 111.993 179.548 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.454 HD23 ' HA ' ' A' ' 73' ' ' ALA . 11.0 mt -57.86 -30.22 65.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.777 -179.381 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 31.4 mm -62.43 -59.1 4.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -70.08 -36.09 74.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.744 0.307 . . . . 0.0 111.485 -179.423 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.554 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -54.6 -55.42 29.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.171 -179.176 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.527 HD22 HD22 ' A' ' 92' ' ' LEU . 16.7 mt -53.91 -12.25 0.54 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.721 0.296 . . . . 0.0 111.188 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -114.29 -15.46 12.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.375 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.1 -41.2 96.25 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.329 0.585 . . . . 0.0 111.256 -179.281 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.626 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 24.1 t70 61.11 28.25 17.97 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.778 -179.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.479 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 56.4 m -82.14 1.11 37.74 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.119 -179.334 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.59 -86.78 1.54 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.528 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -62.65 -44.06 97.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.04 0.448 . . . . 0.0 110.26 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.554 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.8 t -71.2 -39.93 73.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.158 -179.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.626 ' HE ' ' HA ' ' A' ' 65' ' ' ASP . 5.2 ttm180 -68.29 -62.27 1.47 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.688 179.987 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.8 t -53.7 -26.43 22.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.802 179.561 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.34 -46.87 91.34 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.933 179.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.454 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -66.93 -28.58 68.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.702 0.286 . . . . 0.0 110.976 179.516 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.58 -43.89 96.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.815 -179.701 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 3.8 ptp180 -83.05 -37.08 24.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.826 179.808 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.6 m -53.22 -41.31 65.22 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.099 179.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 73' ' ' ALA . 78.4 mt -55.4 -59.32 4.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.888 0.375 . . . . 0.0 110.138 179.049 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -51.88 -32.65 33.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.811 178.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 23.9 mt-30 -66.42 -31.09 71.64 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-O 120.945 0.402 . . . . 0.0 110.366 179.652 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.606 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 90.6 mt -75.91 -61.54 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.464 -179.721 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 57.81 110.63 0.01 OUTLIER Glycine 0 CA--C 1.52 0.389 0 C-N-CA 120.995 -0.622 . . . . 0.0 113.157 179.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 150.82 -165.65 30.2 Favored Glycine 0 C--N 1.33 0.25 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.723 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.553 ' HG3' HH21 ' A' ' 86' ' ' ARG . 1.9 mp0 -72.21 -40.59 67.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.94 0.4 . . . . 0.0 110.643 179.735 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.523 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -54.75 -50.98 67.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.476 179.681 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.523 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 9.9 p -70.85 -27.12 29.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.072 179.4 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.678 ' HG3' ' HE1' ' A' ' 89' ' ' MET . 7.4 ttp180 -58.66 -30.49 67.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.933 -178.764 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.63 -23.37 27.55 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.79 0.292 . . . . 0.0 111.79 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.5 -37.68 71.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.44 -179.327 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.678 ' HE1' ' HG3' ' A' ' 86' ' ' ARG . 9.8 ptt? -72.0 -36.7 69.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.55 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -68.38 -45.27 73.18 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.502 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -60.82 -24.92 66.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.708 179.576 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.527 HD22 HD22 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -86.45 -33.84 20.28 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.403 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.68 -15.23 57.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.062 179.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -84.37 -30.3 25.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.94 179.522 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.5 p -119.82 21.56 11.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.394 179.415 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -50.72 127.0 26.71 Favored Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 114.923 -1.035 . . . . 0.0 113.612 -178.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 t -144.22 130.17 19.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.751 179.015 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 57.89 -152.31 28.06 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.758 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.448 ' HB3' HH12 ' A' ' 70' ' ' ARG . 49.9 t80 -52.77 -33.13 47.21 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.655 0.264 . . . . 0.0 111.348 -179.956 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.448 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -52.3 -40.31 61.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.741 -179.571 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 -71.78 -52.84 15.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.604 -179.597 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -45.61 -26.48 0.61 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.244 0.545 . . . . 0.0 110.51 -179.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 45.6 t -66.93 -57.81 8.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.46 179.617 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.409 ' HB3' ' CD2' ' A' ' 92' ' ' LEU . . . -54.62 -62.17 1.83 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.943 0.719 . . . . 0.0 112.943 -179.135 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.628 HG11 HD21 ' A' ' 106' ' ' ASN . 7.5 p -53.88 -47.1 64.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.721 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.628 HD21 HG11 ' A' ' 105' ' ' VAL . 0.9 OUTLIER -70.79 -35.55 72.61 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.271 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -64.9 -26.18 68.21 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 120.817 0.341 . . . . 0.0 111.385 -178.238 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.425 HD22 ' SD ' ' A' ' 89' ' ' MET . 39.7 mt -49.98 -26.65 4.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.295 179.715 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.53 -6.2 0.67 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.226 -179.399 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 p -114.8 -74.23 0.62 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 13.0 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.916 -179.834 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.469 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.458 -0.048 0 CA-C-O 120.776 0.322 . . . . 0.0 110.709 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.492 ' CE2' ' HB3' ' A' ' 53' ' ' ARG . 1.1 t80 -59.15 -53.17 61.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.515 179.453 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.443 ' O ' ' HG2' ' A' ' 29' ' ' GLU . 4.2 mm-40 -63.51 -57.13 21.21 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.629 179.106 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 32.9 Cg_exo -50.06 -21.96 7.16 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 121.993 1.795 . . . . 0.0 110.892 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.508 HD22 HG13 ' A' ' 46' ' ' ILE . 1.3 tp -79.31 -42.89 24.71 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 114.632 -1.167 . . . . 0.0 109.87 179.717 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.51 HD12 HD11 ' A' ' 31' ' ' LEU . 18.5 tp -75.6 -21.06 58.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.108 178.844 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 15.4 mm-40 -76.45 -40.69 49.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.519 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.6 p -66.24 -16.29 63.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.491 -179.83 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.51 HD11 HD12 ' A' ' 28' ' ' LEU . 78.2 mt -65.71 -8.71 22.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.727 0.298 . . . . 0.0 111.129 179.955 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.4 t -95.08 8.96 41.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.733 179.71 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.618 HD22 ' HB3' ' A' ' 35' ' ' ASP . 0.8 OUTLIER -81.08 128.84 34.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.169 -179.808 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.17 -27.11 65.37 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.276 -179.084 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.618 ' HB3' HD22 ' A' ' 33' ' ' ASN . 36.7 t70 -75.85 163.0 27.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.793 0.33 . . . . 0.0 111.075 -179.59 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 13.5 p90 -107.67 -31.89 7.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.29 -179.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -59.72 -39.03 83.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.0 mt -80.52 -44.75 21.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.828 179.841 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -65.12 -19.56 66.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.741 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.76 -66.44 2.63 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.531 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.1 -35.78 7.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.795 0.331 . . . . 0.0 111.206 179.755 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.2 -49.45 77.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.54 179.622 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.417 ' HB3' HD21 ' A' ' 61' ' ' LEU . . . -68.12 -34.55 76.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.783 179.452 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -67.23 -27.86 67.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.012 -179.234 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.6 mt -99.16 -28.79 3.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.78 0.324 . . . . 0.0 111.617 -179.256 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.508 HG13 HD22 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -60.86 -28.7 43.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.176 -179.32 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -69.4 -24.73 75.98 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.27 179.666 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -64.68 -32.97 74.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.775 0.321 . . . . 0.0 110.463 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.505 ' C ' ' H ' ' A' ' 51' ' ' ASP . 17.8 m-85 -92.32 108.7 20.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.441 179.581 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.418 HE21 ' HB2' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -76.58 31.26 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.035 0.445 . . . . 0.0 111.005 179.885 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.505 ' H ' ' C ' ' A' ' 49' ' ' PHE . 20.8 t70 -85.52 160.32 19.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.903 -179.931 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.98 -40.28 97.27 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.795 -179.316 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.492 ' HB3' ' CE2' ' A' ' 24' ' ' PHE . 39.6 ttm180 -65.33 -12.28 50.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.133 -179.839 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.422 ' O ' HD12 ' A' ' 58' ' ' LEU . . . -106.11 8.94 32.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.134 -179.143 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.402 HG21 ' O ' ' A' ' 51' ' ' ASP . 40.9 t -92.1 -41.73 13.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.213 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.501 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 5.8 tp10 -55.9 -49.17 94.49 Favored Pre-proline 0 C--N 1.331 -0.236 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.088 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.501 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 97.0 Cg_exo -44.24 -52.93 5.23 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.22 1.947 . . . . 0.0 112.055 -179.963 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.422 HD12 ' O ' ' A' ' 54' ' ' ALA . 6.8 mp -51.44 -40.32 59.15 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.888 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.9 mm -59.82 -60.83 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -70.06 -22.35 63.08 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -179.233 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.631 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -76.23 -44.92 35.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -177.966 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.573 HD13 HD22 ' A' ' 77' ' ' LEU . 31.3 mt -62.21 -9.2 7.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.117 0.484 . . . . 0.0 110.698 -179.032 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -127.38 -2.54 6.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.652 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.423 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 47.7 t0 -61.36 -33.89 74.39 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.338 -179.766 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.65 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 3.7 m-20 59.79 25.68 14.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.796 -179.548 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.488 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.9 m -86.29 8.65 20.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.42 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 74.31 -94.31 0.82 Allowed Glycine 0 C--N 1.333 0.361 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.701 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.66 -42.19 78.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.975 0.417 . . . . 0.0 110.502 179.892 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.631 HG12 ' HG ' ' A' ' 61' ' ' LEU . 25.7 t -71.66 -33.19 48.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.726 -179.666 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.65 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 47.6 ttt180 -73.26 -61.23 1.89 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.01 -179.934 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.2 m -51.65 -30.17 20.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.993 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.51 -43.7 95.84 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.35 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.522 ' HA ' ' HB2' ' A' ' 76' ' ' SER . . . -72.35 -34.04 67.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.795 0.331 . . . . 0.0 110.832 179.718 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.65 -44.11 69.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.567 179.759 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.4 ptp85 -83.02 -28.2 29.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.367 179.348 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.522 ' HB2' ' HA ' ' A' ' 73' ' ' ALA . 58.7 m -62.29 -20.98 64.86 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.189 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.573 HD22 HD13 ' A' ' 62' ' ' LEU . 4.9 mt -66.34 -61.26 2.1 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.734 0.302 . . . . 0.0 110.437 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -61.45 -22.28 64.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.761 178.685 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.491 ' HB2' ' HA ' ' A' ' 76' ' ' SER . 0.0 OUTLIER -65.74 -37.85 87.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.165 179.307 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.481 ' HB ' HG23 ' A' ' 85' ' ' VAL . 77.6 mt -87.61 -60.89 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.085 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.66 125.59 0.02 OUTLIER Glycine 0 C--N 1.331 0.258 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.847 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 147.08 -174.13 26.99 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.992 179.743 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -72.21 -22.11 61.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.939 0.4 . . . . 0.0 111.097 -179.889 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.549 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.18 -46.75 60.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.872 -179.935 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.549 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 12.1 t -70.73 -26.64 28.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.447 179.898 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ppt_? -58.69 -20.03 44.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.445 -179.528 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -82.29 -30.56 30.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.595 179.457 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.25 -40.32 74.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.194 179.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.475 ' O ' ' HB3' ' A' ' 104' ' ' ALA . 16.1 ptt? -71.18 -39.18 72.0 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.723 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -64.73 -26.65 68.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.988 0.423 . . . . 0.0 109.899 179.028 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -64.72 -48.01 76.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.23 179.325 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.555 HD11 ' HB3' ' A' ' 62' ' ' LEU . 54.5 mt -68.49 -35.07 77.0 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.403 179.39 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.469 ' HA ' ' CZ ' ' A' ' 101' ' ' ARG . . . -55.18 -33.56 63.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.834 179.058 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -96.99 -11.92 23.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.155 179.681 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.1 m -92.24 -28.62 16.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.951 0.405 . . . . 0.0 111.065 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 62.7 113.3 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.62 -179.642 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.541 ' H ' ' HB2' ' A' ' 101' ' ' ARG . 14.1 p -146.56 -176.58 5.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.734 0.302 . . . . 0.0 111.032 -179.533 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -83.69 -83.71 0.92 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.512 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -78.52 -40.35 35.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.746 0.307 . . . . 0.0 111.01 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.468 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -57.01 -43.32 81.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.651 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.541 ' HB2' ' H ' ' A' ' 97' ' ' THR . 23.8 tpt85 -59.9 -61.39 2.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.497 -179.384 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 54.2 tttt -50.13 -37.37 33.92 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.174 0.511 . . . . 0.0 110.118 179.63 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 11.9 t -61.5 -41.86 91.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.902 179.369 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.507 ' HB2' HD13 ' A' ' 92' ' ' LEU . . . -64.88 -59.75 3.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.139 -179.473 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.438 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 4.4 p -58.96 -47.16 90.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.819 -178.969 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.402 ' N ' HG13 ' A' ' 105' ' ' VAL . 37.0 t30 -64.67 -32.57 74.29 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.559 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -62.45 -26.92 68.77 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 120.666 0.27 . . . . 0.0 111.143 -178.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -51.94 -26.2 9.9 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.25 179.766 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -55.35 -18.37 6.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.284 179.887 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.0 m -101.99 -74.72 0.62 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.936 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.69 179.576 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.404 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 CA--C 1.528 0.106 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.47 ' CE1' ' HB3' ' A' ' 53' ' ' ARG . 2.1 t80 -57.96 -51.34 70.06 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.3 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.419 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -63.37 -57.8 18.56 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.231 179.508 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.419 ' HD3' ' HB2' ' A' ' 25' ' ' GLU . 83.3 Cg_exo -46.57 -25.2 3.3 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 122.065 1.843 . . . . 0.0 111.467 -179.706 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 19.7 mt -77.5 -46.54 22.12 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.894 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.508 HD11 HD13 ' A' ' 31' ' ' LEU . 27.3 tp -68.47 -19.8 64.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.918 178.855 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.58 -23.82 53.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.469 179.824 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.5 m -66.39 -24.08 66.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.132 -179.675 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.552 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 85.3 mt -65.34 -10.77 35.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.842 0.353 . . . . 0.0 110.643 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.6 t -88.67 8.37 28.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.534 179.851 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -102.32 130.04 48.94 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.33 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -68.27 -4.03 12.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.966 179.366 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -77.6 150.54 34.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.734 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 46.9 m0 -88.04 -46.25 9.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.965 -179.973 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -60.29 -37.22 79.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.238 -179.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.9 mt -75.03 -57.28 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.244 -179.781 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.552 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 24.7 ttm180 -59.03 -23.22 61.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.066 -179.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -77.06 -59.07 3.24 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.767 -179.741 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.69 8.37 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.763 0.316 . . . . 0.0 111.502 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.82 -56.53 20.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.769 179.741 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.429 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -65.79 -35.37 80.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.833 179.359 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -55.37 -33.37 63.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.673 -179.582 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.465 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 46.7 mm -99.5 -23.04 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.244 0.545 . . . . 0.0 110.758 -179.835 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.551 HG21 ' HB1' ' A' ' 54' ' ' ALA . 1.0 OUTLIER -60.04 -32.53 50.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.767 -179.209 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.59 -22.2 77.87 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.608 -0.806 . . . . 0.0 113.092 -179.31 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.465 ' ND2' ' HA ' ' A' ' 45' ' ' ILE . 32.1 m-80 -70.74 -8.12 49.87 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.19 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -94.97 -26.81 15.95 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.576 ' HG3' HD12 ' A' ' 80' ' ' ILE . 19.2 mp0 57.76 30.52 19.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.995 0.426 . . . . 0.0 111.005 -179.577 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.406 ' O ' HG21 ' A' ' 55' ' ' VAL . 23.6 t70 -102.43 161.02 14.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.995 -179.822 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -62.44 -37.98 88.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.066 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.47 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 17.9 ttm180 -67.09 -9.0 34.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.586 179.741 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.551 ' HB1' HG21 ' A' ' 46' ' ' ILE . . . -103.74 -9.63 18.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.86 -179.26 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.406 HG21 ' O ' ' A' ' 51' ' ' ASP . 68.1 t -82.91 -35.16 12.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.245 -179.827 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.596 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 26.9 tt0 -60.27 -51.37 80.72 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.778 -179.454 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.596 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 54.1 Cg_exo -52.5 -34.86 64.03 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.148 1.898 . . . . 0.0 112.595 179.988 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.53 HD21 ' HA ' ' A' ' 73' ' ' ALA . 8.7 mt -72.18 -27.27 62.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.202 -179.339 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 33.3 mm -63.05 -59.75 3.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.315 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -70.03 -7.02 37.63 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -178.342 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.561 ' HG ' HG13 ' A' ' 69' ' ' VAL . 3.1 mp -89.84 -40.57 12.35 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -177.997 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.648 ' HB3' HD23 ' A' ' 92' ' ' LEU . 4.3 mt -59.68 -14.81 15.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.278 0.561 . . . . 0.0 110.244 -178.888 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -104.46 -27.93 11.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.441 179.136 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 70' ' ' ARG . 34.2 t70 -59.77 138.31 57.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.853 -179.765 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -110.74 39.04 2.32 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.043 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.472 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 67.2 m -86.49 -30.68 21.79 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.283 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 115.54 -92.06 0.57 Allowed Glycine 0 C--N 1.329 0.175 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.032 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -57.96 -31.55 66.99 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.191 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.561 HG13 ' HG ' ' A' ' 61' ' ' LEU . 22.7 t -69.16 -51.2 45.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.05 179.829 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 57.9 ttp180 -61.02 -58.59 7.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.641 -179.816 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 63.9 m -51.05 -27.09 7.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.867 -179.043 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.61 -56.04 26.73 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.292 179.902 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.53 ' HA ' HD21 ' A' ' 58' ' ' LEU . . . -60.2 -38.66 83.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.909 0.336 . . . . 0.0 111.909 179.767 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.05 -44.42 67.42 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -178.71 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.441 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 7.7 ptp180 -84.57 -35.42 22.81 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.269 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.485 ' HA ' HE21 ' A' ' 79' ' ' GLN . 67.4 m -63.39 -36.05 82.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.048 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.668 HD23 HG13 ' A' ' 85' ' ' VAL . 34.5 mt -61.76 -61.07 2.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.571 0.224 . . . . 0.0 111.221 -179.902 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.421 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 38.1 tt0 -62.25 -19.9 63.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.049 0.452 . . . . 0.0 110.395 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.485 HE21 ' HA ' ' A' ' 76' ' ' SER . 8.2 tt0 -62.83 -25.22 68.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.498 179.668 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.576 HD12 ' HG3' ' A' ' 50' ' ' GLN . 2.5 mm -90.79 -60.14 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.056 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.03 98.27 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.775 -0.648 . . . . 0.0 112.46 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 169.35 -174.15 43.73 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.46 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -70.93 -23.85 62.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.736 0.303 . . . . 0.0 110.673 -179.856 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.519 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -62.7 -53.16 58.72 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.646 179.866 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.668 HG13 HD23 ' A' ' 77' ' ' LEU . 93.6 t -70.65 -24.69 25.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.943 0.401 . . . . 0.0 110.692 179.217 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.3 -27.48 35.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.615 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.86 -30.21 23.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.442 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.13 -38.85 72.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.242 179.894 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.543 ' HE2' HD23 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -68.64 -32.84 72.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.671 179.434 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.457 ' HG3' ' HE1' ' A' ' 89' ' ' MET . 39.6 mt-10 -64.9 -42.51 94.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.316 179.3 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -58.73 -38.17 77.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.084 179.793 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.648 HD23 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -86.54 -23.11 25.97 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.462 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.27 -21.32 62.11 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.528 179.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.47 -26.03 38.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.684 179.591 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 82.4 p -119.59 22.93 11.44 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.248 178.775 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -54.38 123.3 27.48 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.009 -0.996 . . . . 0.0 113.594 -178.781 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.0 t -145.95 130.04 17.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.46 -0.37 . . . . 0.0 110.684 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.09 -139.07 47.99 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.066 -0.588 . . . . 0.0 112.879 -179.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -60.8 -31.55 70.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.811 0.338 . . . . 0.0 111.088 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.471 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -54.1 -42.52 69.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.913 -179.404 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -67.11 -58.49 4.78 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -178.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.572 ' HZ3' ' HB2' ' A' ' 102' ' ' LYS . 4.0 ttmp? -45.52 -30.04 1.33 Allowed 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.046 0.451 . . . . 0.0 110.885 -179.497 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 12.2 t -60.24 -57.08 13.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.236 179.511 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.74 -53.59 48.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.283 -179.194 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.8 t -61.28 -62.01 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -178.195 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -55.61 -29.4 59.08 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -178.124 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.421 ' CE1' ' HA ' ' A' ' 78' ' ' GLU . 3.0 t80 -58.84 -32.96 69.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.927 0.394 . . . . 0.0 110.635 -179.479 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.543 HD23 ' HE2' ' A' ' 89' ' ' MET . 37.6 mt -55.28 -23.44 23.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.606 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.98 6.66 8.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.599 -179.826 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.7 m -126.44 -74.93 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.428 -179.863 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.579 -179.959 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.492 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.627 0.251 . . . . 0.0 111.378 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.551 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 4.7 t80 -53.91 -53.8 47.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.692 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.468 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -63.55 -56.06 29.51 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.362 179.0 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.492 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 83.7 Cg_exo -45.34 -27.52 3.2 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.118 1.879 . . . . 0.0 111.821 179.593 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.592 HD11 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -64.89 -59.14 4.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.756 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 25' ' ' GLU . 4.2 pp -68.53 -19.23 64.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.109 0.48 . . . . 0.0 110.161 178.993 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.436 ' N ' HD13 ' A' ' 28' ' ' LEU . 40.3 tt0 -69.65 -34.69 74.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.453 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.422 ' HG ' ' HA ' ' A' ' 39' ' ' ARG . 34.7 t -66.42 -14.99 62.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.383 -179.827 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.525 HD11 ' HG3' ' A' ' 57' ' ' PRO . 95.9 mt -65.65 -10.26 34.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.804 0.335 . . . . 0.0 110.801 179.858 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.3 m -113.61 12.61 18.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.065 -179.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -78.68 143.05 36.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.847 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -67.79 -25.41 65.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.06 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -87.56 135.06 33.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.953 -179.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 27.9 p-90 -82.24 -35.22 28.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.991 -179.897 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.441 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 40.7 ttp180 -58.73 -30.7 67.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.151 179.785 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.0 mm -82.79 -41.19 17.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.353 179.884 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.422 ' HA ' ' HG ' ' A' ' 30' ' ' SER . 39.6 ttm180 -63.63 -40.14 96.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.553 -179.362 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.463 ' HA2' HG12 ' A' ' 69' ' ' VAL . . . -59.09 -60.55 8.67 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.3 -179.892 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.12 -27.79 2.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.638 0.256 . . . . 0.0 111.317 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.43 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.94 -56.33 23.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.839 179.611 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.536 ' HB3' HD23 ' A' ' 58' ' ' LEU . . . -68.94 -25.33 64.5 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.758 0.313 . . . . 0.0 111.215 179.946 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.6 m95 -55.44 -44.96 76.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.054 -179.453 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.9 mm -99.95 -21.07 5.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.022 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.592 HG13 HD11 ' A' ' 27' ' ' LEU . 4.9 tt -58.21 -30.77 40.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.765 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.481 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -65.39 -16.72 63.2 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.955 -179.399 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.649 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.7 OUTLIER -70.81 -25.04 62.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.641 0.258 . . . . 0.0 111.617 -179.573 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -72.18 -23.63 61.3 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.721 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 56.84 26.21 11.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.932 0.396 . . . . 0.0 111.425 179.83 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -101.99 160.54 14.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.218 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.466 ' O ' HG22 ' A' ' 55' ' ' VAL . 9.8 pt-20 -65.58 -34.14 77.54 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.247 0.546 . . . . 0.0 110.62 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 18.7 ttm180 -69.36 -10.24 57.01 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.415 179.204 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.41 ' C ' ' HD2' ' A' ' 57' ' ' PRO . . . -104.11 -21.07 13.63 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.795 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 52' ' ' GLU . 19.4 m -76.61 -35.99 26.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.113 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.576 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 31.7 tt0 -57.8 -51.88 78.5 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 111.49 0.181 . . . . 0.0 111.49 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.591 ' HG2' HD12 ' A' ' 46' ' ' ILE . 66.6 Cg_exo -52.03 -23.43 16.99 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.131 1.888 . . . . 0.0 112.151 179.399 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.536 HD23 ' HB3' ' A' ' 43' ' ' ALA . 50.6 mt -80.02 -35.97 36.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.496 179.713 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.24 -54.27 37.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.028 -179.588 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -70.12 -14.43 62.65 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -178.366 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.58 ' HG ' HG13 ' A' ' 69' ' ' VAL . 1.5 tp -90.05 -27.45 19.7 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.442 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.589 HD12 HD13 ' A' ' 77' ' ' LEU . 10.1 mt -65.81 -9.77 31.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.139 0.495 . . . . 0.0 110.475 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -121.7 1.8 10.01 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.071 -179.683 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -61.01 -32.15 71.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.19 0.519 . . . . 0.0 111.289 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 52.47 28.65 6.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.333 -0.849 . . . . 0.0 112.02 179.833 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.464 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 7.4 t -85.33 -25.45 27.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.983 0.421 . . . . 0.0 110.818 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.65 -108.83 0.99 Allowed Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.966 -179.832 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.441 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.9 OUTLIER -59.7 -27.46 66.45 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.974 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.58 HG13 ' HG ' ' A' ' 61' ' ' LEU . 17.8 t -66.99 -34.54 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.932 178.968 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -75.73 -49.33 18.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.994 179.16 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 56.7 m -67.1 -21.37 65.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.996 179.414 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -62.74 -63.39 4.67 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.301 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.516 ' HA ' HD21 ' A' ' 58' ' ' LEU . . . -55.23 -25.77 35.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.879 0.371 . . . . 0.0 111.124 179.348 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.441 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.78 -58.28 8.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.55 -179.63 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -64.6 -37.59 88.1 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.324 -179.729 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.481 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 38.6 m -55.79 -38.38 69.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.208 -179.694 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.589 HD13 HD12 ' A' ' 62' ' ' LEU . 15.8 mt -69.73 -60.02 2.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.666 179.303 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.417 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 29.9 mt-10 -51.7 -25.93 8.29 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.245 0.545 . . . . 0.0 109.927 178.436 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.419 ' HB3' ' O ' ' A' ' 76' ' ' SER . 6.3 tt0 -70.11 -44.09 69.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.904 179.164 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.434 ' HB ' HG11 ' A' ' 85' ' ' VAL . 79.9 mt -57.59 -58.43 6.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.201 178.901 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.489 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 70.29 135.41 0.1 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.915 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 124.73 174.81 14.11 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.828 179.685 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -61.79 -22.91 65.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.989 0.423 . . . . 0.0 110.551 179.562 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.508 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -55.13 -63.21 1.23 Allowed 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.829 -179.896 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.434 HG11 ' HB ' ' A' ' 80' ' ' ILE . 5.2 m -70.28 -24.55 25.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.815 179.819 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.409 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 48.6 ttt180 -55.86 -28.71 57.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.498 -178.566 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.19 -26.44 26.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.861 0.363 . . . . 0.0 110.706 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.538 ' HB1' ' HE3' ' A' ' 89' ' ' MET . . . -71.48 -46.18 60.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.087 179.918 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.572 ' HE2' ' HB3' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -72.11 -37.45 69.52 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 179.828 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 30.8 mt-10 -55.56 -37.15 67.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.95 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -81.52 -20.96 38.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.901 179.328 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.481 HD21 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -83.21 -26.13 31.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.663 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.66 -24.85 67.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.728 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -80.04 -22.7 42.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.293 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 30.2 p -120.39 15.93 12.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.173 179.227 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -56.33 127.55 43.92 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 114.794 -1.093 . . . . 0.0 113.468 -178.936 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.0 t -139.78 130.3 25.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.963 0.411 . . . . 0.0 110.55 178.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.6 -132.03 51.29 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.705 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -69.49 -33.92 73.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.635 0.255 . . . . 0.0 111.589 -179.716 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.421 ' O ' HD22 ' A' ' 92' ' ' LEU . . . -49.79 -33.01 15.28 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.008 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.404 ' C ' ' N ' ' A' ' 103' ' ' VAL . 49.9 ttp180 -79.76 -52.52 7.82 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -178.823 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -45.91 -23.24 0.27 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.263 0.554 . . . . 0.0 110.429 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.441 HG21 ' HB1' ' A' ' 74' ' ' ALA . 55.6 t -71.47 -60.24 2.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.341 179.664 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.06 -49.95 67.85 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.208 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.0 t -64.87 -63.23 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.215 -0.902 . . . . 0.0 113.008 -177.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -55.39 -46.29 76.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.626 -178.379 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.489 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 39.2 t80 -60.0 -37.54 80.02 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.196 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.499 ' O ' HD12 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -49.82 -25.31 2.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.373 -178.116 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.2 6.27 1.02 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.683 -179.767 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 110' ' ' THR . . . . . 0.409 ' H ' ' C ' ' A' ' 108' ' ' LEU . 76.8 p -96.4 -71.24 0.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.595 0.236 . . . . 0.0 111.445 -179.887 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 62.4 t-80 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.805 179.964 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.586 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.231 0.093 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.536 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -61.04 -51.12 70.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.984 0.421 . . . . 0.0 110.584 179.904 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -62.94 -52.99 59.5 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.1 179.806 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.586 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 74.3 Cg_exo -40.61 -28.93 0.36 Allowed 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 122.257 1.972 . . . . 0.0 111.722 179.285 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 49.2 mt -72.64 -55.04 7.46 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.101 178.714 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.571 HD12 HD13 ' A' ' 31' ' ' LEU . 23.8 tp -63.09 -22.9 67.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.167 179.021 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -83.18 -34.17 26.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.996 179.763 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.3 t -66.23 -16.18 63.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.901 179.772 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.571 HD13 HD12 ' A' ' 28' ' ' LEU . 80.3 mt -63.4 -13.22 37.42 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.877 -179.999 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 90.3 p -100.64 22.34 12.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.773 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.01 146.18 27.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.963 -179.827 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -66.44 -20.9 66.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.385 -179.784 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -83.87 162.8 20.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.379 . . . . 0.0 111.176 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 14.5 p90 -103.11 -40.34 6.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.175 -179.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -61.72 -30.34 70.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.137 -179.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 31.8 mm -78.51 -42.05 25.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.452 -179.431 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.431 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 41.6 ttm180 -62.96 -44.7 95.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.302 -179.632 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.24 -57.92 12.05 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.892 -179.679 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.89 -28.9 4.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.718 0.294 . . . . 0.0 111.582 -179.811 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.428 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -63.7 -50.56 68.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.951 179.862 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.41 ' CB ' HD22 ' A' ' 61' ' ' LEU . . . -74.82 -25.23 58.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.432 -179.893 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -60.63 -37.98 83.25 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.408 -179.878 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.2 mm -99.53 -19.77 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.799 -179.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.428 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 4.3 tt -59.81 -36.79 68.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -178.417 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.412 ' HA2' HD12 ' A' ' 80' ' ' ILE . . . -70.97 -7.44 62.27 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.465 -0.874 . . . . 0.0 113.39 -179.099 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.545 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.9 OUTLIER -70.78 -26.45 63.34 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -179.241 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -87.03 -27.03 23.44 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.813 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.548 ' HG3' HD13 ' A' ' 80' ' ' ILE . 1.1 mp0 60.74 60.94 1.78 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.76 0.314 . . . . 0.0 111.524 -179.607 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -127.99 176.95 7.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.787 179.47 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -64.22 -34.23 77.61 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.931 179.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.498 ' HE ' ' HA ' ' A' ' 53' ' ' ARG . 1.8 mmp_? -68.56 -11.44 59.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.252 -179.899 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.39 10.38 33.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.956 -179.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.5 t -91.54 -58.49 3.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.056 -179.275 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.434 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 39.4 tt0 -60.5 -46.28 97.37 Favored Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.094 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.465 ' HG3' HD11 ' A' ' 28' ' ' LEU . 95.2 Cg_exo -43.67 -48.08 9.07 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.191 1.927 . . . . 0.0 112.647 -179.898 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.505 HD21 ' HA ' ' A' ' 73' ' ' ALA . 10.3 mt -59.74 -36.51 76.76 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.276 -179.477 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.489 HD12 ' HB1' ' A' ' 88' ' ' ALA . 40.2 mm -61.39 -61.15 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.181 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 ptpt -70.25 -11.91 61.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.978 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.614 HD21 ' H ' ' A' ' 73' ' ' ALA . 1.3 tp -89.97 -45.75 8.98 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -177.821 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 58' ' ' LEU . 3.9 pp -67.26 -8.38 31.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 111.291 -178.438 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -101.71 -4.32 26.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.189 -179.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.417 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 2.1 m-20 -61.3 -33.85 74.25 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.61 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.6 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 38.4 m-20 59.6 27.58 16.82 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.183 -179.35 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.457 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 11.7 m -82.12 -31.83 30.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.59 -179.335 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 135.78 -109.36 0.74 Allowed Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.792 -179.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -58.14 -28.71 64.95 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.757 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.457 ' HB ' ' HB2' ' A' ' 66' ' ' SER . 49.4 t -65.5 -45.9 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.477 178.688 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.6 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 53.0 ttp180 -62.0 -48.88 78.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.389 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.9 m -67.12 -24.8 65.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.205 -179.993 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -55.37 -69.78 1.16 Allowed Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.386 -179.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.614 ' H ' HD21 ' A' ' 61' ' ' LEU . . . -47.56 -31.98 4.94 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 179.295 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.86 -47.64 84.1 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.26 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -71.29 -40.3 70.95 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.157 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.588 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 6.7 p -54.46 -27.85 40.37 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.692 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.572 ' HB3' HG12 ' A' ' 85' ' ' VAL . 17.6 mt -55.12 -60.69 3.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.743 0.306 . . . . 0.0 110.696 179.944 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.429 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 34.2 mt-10 -48.88 -36.9 18.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.989 178.262 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.588 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 22.1 mt-30 -67.3 -30.4 70.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.855 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.548 HD13 ' HG3' ' A' ' 50' ' ' GLN . 50.6 mm -80.1 -60.48 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.337 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.585 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . 150.45 142.89 3.63 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.479 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.446 ' O ' ' HB2' ' A' ' 86' ' ' ARG . . . -69.27 -50.03 35.66 Favored Glycine 0 C--O 1.223 -0.569 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.16 -179.475 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -55.27 -35.94 65.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.586 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.585 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.0 OUTLIER -86.2 -58.59 2.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.005 0.431 . . . . 0.0 111.484 -179.046 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.572 HG12 ' HB3' ' A' ' 77' ' ' LEU . 75.7 t -60.09 -21.75 22.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.734 -179.489 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 12.1 ttp180 -52.95 -31.17 38.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.926 0.393 . . . . 0.0 110.608 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.05 -33.29 70.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.775 179.219 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.489 ' HB1' HD12 ' A' ' 59' ' ' ILE . . . -71.58 -46.27 59.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.441 179.444 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.524 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 24.8 mmm -63.08 -48.95 76.42 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.819 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -51.27 -33.27 27.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.617 178.829 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 60.7 tptt -79.03 -26.41 43.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.0 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.645 HD22 ' HB2' ' A' ' 104' ' ' ALA . 2.0 tp -82.29 -25.55 33.89 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.566 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.93 -22.5 65.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.269 0.557 . . . . 0.0 109.604 178.897 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -80.25 -29.75 38.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.556 179.041 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 15.5 p -108.61 19.05 20.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.673 178.97 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.498 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -51.51 114.14 2.82 Favored Glycine 0 N--CA 1.447 -0.597 0 CA-C-N 115.237 -0.892 . . . . 0.0 113.235 -179.117 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.0 t -139.8 130.1 25.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.857 0.36 . . . . 0.0 110.799 179.348 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.29 -127.85 44.59 Favored Glycine 0 CA--C 1.519 0.326 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.862 179.929 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 70' ' ' ARG . 24.6 t80 -74.04 -31.52 62.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.71 0.29 . . . . 0.0 111.278 -179.808 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.501 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -51.66 -37.05 48.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.032 -179.248 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.498 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 29.6 ttt180 -67.37 -58.61 4.46 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.371 -179.535 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -47.03 -24.77 0.68 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.788 -179.973 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.501 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 55.6 t -66.01 -60.67 2.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.506 179.846 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.645 ' HB2' HD22 ' A' ' 92' ' ' LEU . . . -59.26 -39.66 83.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.901 -179.559 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 38.5 t -64.94 -58.22 8.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.69 -0.687 . . . . 0.0 112.445 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.561 ' N ' HD21 ' A' ' 106' ' ' ASN . 0.8 OUTLIER -68.76 -43.33 76.01 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -178.03 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.524 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 62.6 t80 -60.83 -45.6 93.83 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -178.41 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.489 ' HB3' ' O ' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -50.13 -19.66 0.81 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.709 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -71.27 6.58 1.64 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.765 179.423 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 110' ' ' THR . . . . . 0.425 ' H ' ' C ' ' A' ' 108' ' ' LEU . 26.5 p -92.91 -40.46 10.59 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.017 0.436 . . . . 0.0 110.109 179.715 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.985 179.333 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.668 0.271 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.8 t80 -55.33 -53.19 59.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.333 179.5 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.39 -57.05 21.94 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.573 178.996 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.515 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 96.4 Cg_exo -41.74 -33.2 1.84 Allowed 'Trans proline' 0 C--N 1.359 1.109 0 C-N-CA 122.321 2.014 . . . . 0.0 111.607 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 22.8 mt -61.93 -58.25 8.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.927 178.706 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.509 HD11 HD11 ' A' ' 31' ' ' LEU . 11.0 tp -64.75 -21.15 66.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.911 178.693 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -74.38 -33.16 62.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.258 179.828 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.1 m -66.44 -17.34 64.73 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.753 -179.753 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.509 HD11 HD11 ' A' ' 28' ' ' LEU . 81.8 mt -65.49 -6.75 11.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.838 0.352 . . . . 0.0 110.804 179.852 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 53.1 m -121.62 17.07 11.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.356 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.447 HD22 ' HB3' ' A' ' 35' ' ' ASP . 11.4 t30 -88.04 137.19 32.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.858 -179.785 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -53.28 -37.48 62.23 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.584 -179.575 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.447 ' HB3' HD22 ' A' ' 33' ' ' ASN . 16.9 t70 -76.09 133.65 40.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.705 -179.672 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -92.03 -27.27 17.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.363 -179.559 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 -60.61 -36.17 77.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.139 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.8 mt -81.91 -38.92 16.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.17 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.472 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.6 ttm180 -56.43 -26.07 52.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.597 179.85 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.42 -63.27 3.46 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.219 179.723 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.82 -24.36 1.41 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.791 0.329 . . . . 0.0 111.346 179.787 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.413 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.98 -57.17 13.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.348 -179.957 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.16 -24.75 62.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.89 0.376 . . . . 0.0 111.195 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.417 ' NE1' ' HA2' ' A' ' 72' ' ' GLY . 6.5 m95 -55.42 -44.69 76.5 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.253 -178.884 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.4 mt -99.11 -20.4 5.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.755 0.312 . . . . 0.0 111.706 -179.381 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.568 HG12 ' HA ' ' A' ' 54' ' ' ALA . 1.4 tt -55.48 -34.12 33.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.681 -179.086 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.23 -27.57 72.55 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.783 -0.723 . . . . 0.0 113.334 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -70.73 -0.04 8.04 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.356 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -91.51 -38.22 12.66 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 -179.829 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.504 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.0 OUTLIER 69.57 44.96 0.84 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.272 0.558 . . . . 0.0 110.714 179.831 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.414 ' O ' HG21 ' A' ' 55' ' ' VAL . 4.9 m-20 -126.94 164.06 22.29 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.907 -179.843 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -61.57 -40.78 95.98 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.103 -179.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.468 ' HG3' HD21 ' A' ' 28' ' ' LEU . 14.0 ttm180 -67.25 -9.65 42.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.798 179.889 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.568 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -104.25 -8.89 19.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.14 -179.003 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.414 HG21 ' O ' ' A' ' 51' ' ' ASP . 71.2 t -91.72 -36.73 8.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.517 -179.767 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.592 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 13.5 tt0 -60.27 -51.93 76.74 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -179.395 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.592 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 51.0 Cg_exo -54.99 -17.67 14.87 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 122.273 1.982 . . . . 0.0 112.821 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.424 HD12 HD13 ' A' ' 77' ' ' LEU . 14.5 mt -85.82 -36.06 20.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.965 -179.76 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.6 mm -61.15 -53.34 50.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.801 -179.452 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -70.03 -13.71 62.35 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.88 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.556 ' HG ' HG11 ' A' ' 69' ' ' VAL . 1.9 mp -89.86 -36.36 15.11 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -177.961 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.523 HD11 HD23 ' A' ' 92' ' ' LEU . 9.0 mt -63.48 -9.16 11.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.836 0.351 . . . . 0.0 111.132 -178.34 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -111.78 -11.88 13.9 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.365 -179.823 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.404 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 3.0 t70 -61.07 -32.49 72.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.12 0.486 . . . . 0.0 111.111 179.978 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.4 t70 47.61 30.35 1.71 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.793 179.885 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.44 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 22.7 t -86.28 -36.26 19.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.864 0.364 . . . . 0.0 111.426 -179.767 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 130.2 -96.95 0.37 Allowed Glycine 0 C--O 1.228 -0.253 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 -178.875 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.06 -32.61 55.17 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.966 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.556 HG11 ' HG ' ' A' ' 61' ' ' LEU . 16.3 t -73.77 -59.99 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.032 179.286 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.418 ' HA ' ' O ' ' A' ' 61' ' ' LEU . 7.6 tmm_? -69.4 -63.33 1.09 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.675 -179.209 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 22.9 t -51.76 -24.89 6.51 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.005 0.431 . . . . 0.0 110.764 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.417 ' HA2' ' NE1' ' A' ' 44' ' ' TRP . . . -63.51 -61.25 6.43 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.699 -0.762 . . . . 0.0 111.714 179.347 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.51 -25.47 68.04 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.722 0.296 . . . . 0.0 110.973 179.243 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -52.42 -46.26 66.28 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.115 -179.366 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.454 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 11.5 ptp180 -81.34 -30.77 33.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.776 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.49 ' HA ' HE21 ' A' ' 79' ' ' GLN . 14.7 m -53.19 -44.14 67.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.353 -179.673 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.672 ' HB3' ' HE1' ' A' ' 89' ' ' MET . 9.0 mp -55.47 -59.61 4.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.836 179.766 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -52.37 -31.23 32.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.472 179.489 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.49 HE21 ' HA ' ' A' ' 76' ' ' SER . 34.0 mt-30 -62.95 -36.94 85.13 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.911 0.386 . . . . 0.0 110.395 179.631 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.504 HG23 ' HG3' ' A' ' 50' ' ' GLN . 69.2 mt -71.63 -55.2 14.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.543 179.432 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.543 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 63.12 -175.57 8.22 Favored Glycine 0 N--CA 1.453 -0.218 0 CA-C-N 115.979 -0.555 . . . . 0.0 113.383 179.407 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.563 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 73.49 168.35 14.98 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.349 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.43 ' HG3' HH21 ' A' ' 86' ' ' ARG . 40.2 tt0 -55.65 -21.12 16.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.927 0.394 . . . . 0.0 110.724 179.621 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.563 HH11 ' HA3' ' A' ' 82' ' ' GLY . 2.7 mpt_? -60.84 -65.6 0.66 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.242 -178.855 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.52 HG21 ' HE3' ' A' ' 89' ' ' MET . 2.5 p -70.88 -23.13 23.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.181 0.515 . . . . 0.0 110.105 179.492 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.43 HH21 ' HG3' ' A' ' 83' ' ' GLU . 23.2 ttp180 -54.61 -19.46 6.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.273 -179.815 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -79.56 -36.65 37.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.43 -35.87 72.76 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.606 179.607 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.672 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 8.4 mmt -59.23 -62.74 1.66 Allowed 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.86 178.987 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -51.56 -36.55 45.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.93 179.394 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -73.53 -28.16 61.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.589 -179.825 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.631 HD22 ' HB1' ' A' ' 104' ' ' ALA . 2.4 tp -86.19 -27.15 24.71 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.581 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.28 -28.28 64.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.684 179.039 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -80.14 -27.51 39.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.766 179.455 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.4 p -112.16 27.03 10.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.484 179.245 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.556 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -50.53 119.8 7.84 Favored Glycine 0 N--CA 1.448 -0.552 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.818 -178.852 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 t -142.58 130.68 21.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.521 -0.339 . . . . 0.0 110.42 179.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.92 -132.37 19.43 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.318 -179.567 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.07 -15.88 23.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.803 0.335 . . . . 0.0 110.588 179.998 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.444 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -56.93 -37.06 70.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.648 179.638 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.556 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 61.0 ttt180 -57.19 -61.28 2.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.343 179.458 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -53.32 -32.8 50.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.309 179.379 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.444 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 9.6 t -62.45 -51.94 66.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.499 179.974 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.631 ' HB1' HD22 ' A' ' 92' ' ' LEU . . . -56.15 -62.24 1.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -178.914 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.427 HG11 ' N ' ' A' ' 106' ' ' ASN . 6.0 p -57.77 -53.38 45.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.022 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.427 ' N ' HG11 ' A' ' 105' ' ' VAL . 41.2 t30 -61.83 -39.16 90.83 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -178.787 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.543 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 63.4 t80 -62.16 -23.96 66.9 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 120.836 0.35 . . . . 0.0 111.263 -178.613 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.2 mt -53.65 -22.78 9.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.411 -179.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -77.63 7.17 5.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.246 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.0 m -130.05 -52.97 1.12 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.444 -179.548 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.104 -0.95 . . . . 0.0 111.433 -179.95 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.475 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.614 0.245 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 3.1 t80 -49.44 -44.65 45.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.537 178.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -63.48 -56.71 24.31 Favored Pre-proline 0 N--CA 1.465 0.297 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.307 -179.584 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.475 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 70.5 Cg_exo -37.39 -25.24 0.06 OUTLIER 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 122.863 2.376 . . . . 0.0 112.759 179.244 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 27.1 mt -72.33 -54.26 9.99 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.742 179.215 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 46' ' ' ILE . 12.9 mt -67.96 -26.06 65.75 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.134 179.044 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -63.72 -41.04 98.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.497 -179.614 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.2 m -66.05 -15.45 63.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.578 -179.765 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.531 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 88.1 mt -67.63 -10.98 57.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.726 0.298 . . . . 0.0 111.056 -179.728 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.5 t -98.09 15.88 22.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.089 -179.868 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.678 HD22 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -86.69 149.63 24.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.96 0.41 . . . . 0.0 111.12 -179.903 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.74 -37.46 82.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.994 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.13 158.21 32.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.956 -179.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 1.5 p90 -106.25 -21.0 13.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.962 179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -64.76 -51.57 61.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.799 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.0 mt -62.32 -40.41 87.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.439 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.678 ' HB2' HD22 ' A' ' 33' ' ' ASN . 31.1 ttm180 -63.12 -20.98 65.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.534 179.56 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.92 -64.53 3.86 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.549 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.56 -36.31 4.57 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.694 0.283 . . . . 0.0 111.498 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.23 -47.94 83.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.992 0.425 . . . . 0.0 110.338 179.438 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.408 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -69.04 -30.91 69.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.112 179.533 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -70.73 -34.01 71.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.519 -178.704 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 35.9 mt -98.32 -19.34 5.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.82 0.343 . . . . 0.0 111.502 -179.464 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.567 HG21 ' HB1' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -56.1 -35.63 42.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.136 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.21 -18.48 78.06 Favored Glycine 0 C--N 1.329 0.16 0 C-N-CA 120.566 -0.826 . . . . 0.0 113.592 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -58.16 -34.22 70.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.007 0.403 . . . . 0.0 111.098 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.479 ' C ' ' H ' ' A' ' 51' ' ' ASP . 12.0 m-85 -94.07 118.67 31.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.964 0.411 . . . . 0.0 110.963 179.593 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -72.13 20.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.81 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.479 ' H ' ' C ' ' A' ' 49' ' ' PHE . 28.7 t0 -83.8 137.25 33.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.754 0.311 . . . . 0.0 110.552 179.907 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -10.32 32.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.788 -179.044 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.438 ' HG2' HD12 ' A' ' 28' ' ' LEU . 12.3 ttt180 -62.28 -32.36 73.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.775 0.321 . . . . 0.0 110.652 -179.852 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.567 ' HB1' HG21 ' A' ' 46' ' ' ILE . . . -104.8 20.15 19.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.58 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.0 p -73.64 -38.66 52.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.823 0.344 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.461 ' HG3' ' HZ1' ' A' ' 60' ' ' LYS . 19.2 tt0 -60.29 -53.35 65.71 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.591 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.45 ' O ' HD12 ' A' ' 61' ' ' LEU . 69.7 Cg_exo -38.91 -53.16 2.01 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.494 2.129 . . . . 0.0 112.635 179.702 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.544 ' HB3' HD23 ' A' ' 77' ' ' LEU . 11.6 mt -55.58 -48.29 75.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.5 -179.503 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 35.8 mm -58.03 -54.61 29.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.657 -179.46 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.461 ' HZ1' ' HG3' ' A' ' 56' ' ' GLU . 43.8 mmtm -69.81 -11.96 61.26 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.534 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.624 ' HG ' HG11 ' A' ' 69' ' ' VAL . 0.4 OUTLIER -87.46 -47.16 8.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.843 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.432 HD23 HD23 ' A' ' 92' ' ' LEU . 5.6 mt -56.24 -16.91 6.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.12 0.486 . . . . 0.0 110.846 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.06 -12.81 14.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.319 179.951 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.403 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.6 t0 -61.13 -35.52 77.28 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.18 0.514 . . . . 0.0 110.911 -179.958 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.547 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 42.9 m-20 52.59 29.95 7.93 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.747 179.792 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.444 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 43.9 t -84.36 -3.62 58.4 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.82 0.343 . . . . 0.0 111.028 179.892 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.88 -90.64 1.46 Allowed Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.434 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.79 -45.68 89.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.162 0.506 . . . . 0.0 109.801 179.435 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.624 HG11 ' HG ' ' A' ' 61' ' ' LEU . 21.3 t -69.19 -42.52 81.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.379 -179.873 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.547 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 0.9 OUTLIER -66.83 -62.84 1.24 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.023 -179.816 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.419 ' HA ' HH21 ' A' ' 70' ' ' ARG . 95.2 p -54.67 -24.94 23.97 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.005 179.715 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.58 -35.19 79.47 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.601 -179.915 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.424 ' O ' HD21 ' A' ' 77' ' ' LEU . . . -73.66 -38.61 64.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.556 0.217 . . . . 0.0 111.073 179.79 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HB2' HH22 ' A' ' 70' ' ' ARG . . . -42.49 -42.06 3.17 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.027 -179.04 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -84.14 -31.23 25.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.285 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.584 ' HA ' HE21 ' A' ' 79' ' ' GLN . 67.7 m -63.06 -46.3 88.14 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.743 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.621 ' HB3' HG13 ' A' ' 85' ' ' VAL . 3.8 mm? -55.34 -60.93 2.72 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.73 0.3 . . . . 0.0 111.534 -178.909 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -61.25 -27.04 68.17 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.758 0.313 . . . . 0.0 111.459 179.807 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.584 HE21 ' HA ' ' A' ' 76' ' ' SER . 5.0 mt-30 -70.55 -24.57 62.82 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.174 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.539 ' HB ' HG21 ' A' ' 85' ' ' VAL . 85.0 mt -74.86 -60.99 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.141 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 179.55 -135.68 2.58 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 119.911 -1.137 . . . . 0.0 113.711 -179.49 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.556 ' H ' HH11 ' A' ' 84' ' ' ARG . . . -127.51 -78.89 0.27 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 121.151 -0.547 . . . . 0.0 112.508 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -58.67 -21.27 53.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.82 0.343 . . . . 0.0 111.766 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.556 HH11 ' H ' ' A' ' 82' ' ' GLY . 4.3 mpt_? -75.97 -62.88 1.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.243 0.544 . . . . 0.0 110.28 -178.715 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.621 HG13 ' HB3' ' A' ' 77' ' ' LEU . 39.4 t -70.72 -20.43 22.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.988 179.653 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 23.3 ttm180 -46.47 -26.71 0.91 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.746 -179.939 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.5 -36.3 22.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.778 179.794 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.91 -44.26 77.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.36 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.533 ' HE3' ' HB1' ' A' ' 104' ' ' ALA . 4.3 ppp? -64.3 -28.69 69.89 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.912 0.387 . . . . 0.0 110.049 179.88 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.418 ' N ' ' SD ' ' A' ' 89' ' ' MET . 22.5 mt-10 -70.42 -37.6 74.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.636 179.015 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.459 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 7.3 tmtm? -66.68 -33.83 76.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.393 179.358 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.432 HD23 HD23 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -85.84 -27.37 25.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.931 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.28 -30.37 69.41 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.456 179.064 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -80.18 -25.07 39.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.358 179.934 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 61.8 p -110.96 20.89 17.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.14 179.067 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.57 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -51.34 119.19 7.74 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.701 -178.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.1 m -152.67 130.27 11.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.545 -0.328 . . . . 0.0 110.503 179.189 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.46 -144.61 49.34 Favored Glycine 0 CA--C 1.518 0.275 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.481 -179.839 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -68.71 -29.33 67.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.81 0.338 . . . . 0.0 110.839 179.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.525 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -50.13 -41.73 49.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.519 -179.911 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.57 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 74.7 ttt180 -67.79 -54.49 18.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.524 -179.549 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -45.79 -28.51 1.08 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.281 -179.771 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.525 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 53.6 t -61.8 -60.19 3.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.057 179.242 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.533 ' HB1' ' HE3' ' A' ' 89' ' ' MET . . . -53.54 -62.02 1.93 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.274 0.559 . . . . 0.0 111.776 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.446 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 46.3 t -54.41 -59.22 2.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.843 -178.643 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -56.84 -32.26 65.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.717 0.294 . . . . 0.0 111.612 -179.17 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.427 ' OH ' ' HA2' ' A' ' 82' ' ' GLY . 3.9 t80 -59.34 -27.88 66.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.047 0.451 . . . . 0.0 110.453 -179.678 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.484 ' HG ' ' HE2' ' A' ' 89' ' ' MET . 41.8 mt -56.48 -22.25 31.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.398 179.884 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -56.04 -17.83 7.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.475 -179.887 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.1 p -93.7 -64.63 1.06 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.975 179.723 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.434 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 80.0 m80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.323 -0.846 . . . . 0.0 110.718 179.903 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.462 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.457 -0.102 0 CA-C-O 120.753 0.311 . . . . 0.0 111.653 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.442 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -58.0 -51.77 68.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 179.698 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.39 -54.02 47.71 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.725 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.462 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 89.5 Cg_exo -40.1 -35.94 1.34 Allowed 'Trans proline' 0 C--N 1.362 1.272 0 C-N-CA 122.177 1.918 . . . . 0.0 111.433 -179.955 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 27.1 mt -66.86 -53.91 27.65 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.985 178.501 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.436 ' HA ' HD12 ' A' ' 31' ' ' LEU . 35.5 tp -61.65 -19.95 62.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.823 179.34 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -75.73 -43.25 47.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.21 -179.614 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.7 m -65.98 -14.37 61.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.363 -179.689 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.513 HD13 HG13 ' A' ' 46' ' ' ILE . 65.9 mt -70.33 -10.43 58.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.271 -179.918 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.6 p -101.79 10.32 40.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.701 179.795 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -81.65 145.76 30.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.76 -18.13 64.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.893 -179.957 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -77.71 142.15 38.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.921 -179.947 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 12.3 p90 -96.59 -22.2 17.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.148 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -72.2 -37.72 69.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.018 0.437 . . . . 0.0 110.693 -179.981 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.513 ' N ' HD13 ' A' ' 38' ' ' ILE . 1.8 mp -81.66 -36.13 14.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.736 -179.766 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.486 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 20.3 ttm180 -65.19 -25.51 67.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.489 -179.955 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.19 -64.59 3.05 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.509 -179.995 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.65 -39.48 24.38 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.661 0.267 . . . . 0.0 110.911 179.76 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.451 ' O ' HG12 ' A' ' 46' ' ' ILE . . . -57.25 -55.39 35.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.236 179.298 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.44 -33.93 71.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.255 179.209 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -64.97 -30.17 71.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.181 -179.814 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.438 ' O ' ' HB2' ' A' ' 48' ' ' ASN . 66.4 mt -98.73 -18.91 6.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.312 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.513 HG13 HD13 ' A' ' 31' ' ' LEU . 4.5 mm -50.41 -61.19 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.315 -179.234 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.673 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -68.56 -3.42 33.3 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.85 -0.691 . . . . 0.0 113.992 -178.395 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.579 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.8 OUTLIER -70.74 0.22 7.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 117.242 0.521 . . . . 0.0 111.078 -179.964 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -106.07 -23.01 12.73 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -179.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.592 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.6 OUTLIER 62.32 20.48 11.83 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.899 0.38 . . . . 0.0 110.946 -179.683 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -96.82 171.9 8.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.149 -179.874 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -66.41 -34.12 77.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.161 179.738 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -66.73 -13.23 61.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.963 0.411 . . . . 0.0 111.09 -179.719 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.456 ' HA ' HG22 ' A' ' 46' ' ' ILE . . . -101.68 6.38 41.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.928 -179.304 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.3 p -92.24 -39.11 11.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.553 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 35.7 tt0 -60.26 -51.9 76.98 Favored Pre-proline 0 CA--C 1.53 0.211 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -178.99 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.553 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 88.1 Cg_exo -47.07 -49.21 13.07 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 121.881 1.721 . . . . 0.0 111.615 179.507 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.506 ' HA ' ' HB2' ' A' ' 73' ' ' ALA . 10.3 mt -56.77 -37.37 70.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.376 -179.697 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.6 mm -61.89 -59.33 4.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.901 0.382 . . . . 0.0 111.985 -179.396 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.3 mmmt -70.02 -9.72 56.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.32 -178.873 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.601 ' HG ' HG13 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -87.46 -44.34 11.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -178.327 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.664 HD12 HD22 ' A' ' 92' ' ' LEU . 7.6 mt -59.19 -11.32 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.095 0.474 . . . . 0.0 110.641 -179.119 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -116.03 -14.84 11.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.153 -179.926 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -61.23 -22.95 65.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.248 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.57 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 4.0 p30 41.51 32.28 0.22 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.411 -0.813 . . . . 0.0 112.153 179.786 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.445 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 22.2 t -86.18 -8.73 57.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.195 -179.998 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.89 -86.03 1.09 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.248 -179.765 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.45 -42.95 99.56 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.103 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.601 HG13 ' HG ' ' A' ' 61' ' ' LEU . 4.2 t -68.69 -49.29 65.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.338 -179.766 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.57 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 51.5 ttp180 -62.7 -41.48 99.16 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.233 -179.758 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 80.5 p -64.26 -31.51 72.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.995 -179.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.21 -28.56 69.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.515 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.506 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . . . -74.3 -58.55 3.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.655 0.264 . . . . 0.0 111.588 -179.844 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -60.1 -23.93 64.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.833 -179.204 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.6 ttt-85 -81.39 -47.86 12.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.722 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.673 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 8.7 m -67.22 -30.13 69.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.754 -179.494 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 74' ' ' ALA . 18.3 mt -60.76 -59.81 4.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.833 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -54.45 -36.3 63.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.234 179.392 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.541 HE21 ' HA ' ' A' ' 76' ' ' SER . 47.6 mt-30 -58.93 -37.36 76.51 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.918 0.39 . . . . 0.0 110.913 179.718 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.592 HG12 ' HG3' ' A' ' 50' ' ' GLN . 98.3 mt -71.97 -60.32 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.924 179.856 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 67.96 123.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.632 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.565 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 142.93 175.51 16.11 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.68 179.873 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -65.85 -26.15 67.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.761 0.315 . . . . 0.0 111.11 -179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.565 HH11 ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -61.84 -54.31 43.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.665 -179.405 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.562 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 3.4 m -70.71 -23.8 24.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.84 0.352 . . . . 0.0 111.306 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.479 ' HA ' ' HG2' ' A' ' 89' ' ' MET . 68.5 ttt180 -58.64 -40.87 84.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.968 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.78 -33.45 70.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.738 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.22 -34.23 77.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.412 179.526 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.512 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 17.6 mmm -69.27 -55.44 10.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.042 -0.527 . . . . 0.0 109.981 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -54.03 -33.53 57.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.4 179.377 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -79.24 -22.84 44.22 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.683 179.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.704 HD21 ' HB3' ' A' ' 104' ' ' ALA . 1.8 tp -87.16 -30.67 20.87 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.707 179.858 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.77 -32.17 69.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.527 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.456 ' HG3' HG23 ' A' ' 95' ' ' THR . 12.9 pt-20 -80.39 -20.97 42.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.09 0.472 . . . . 0.0 110.15 179.853 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.456 HG23 ' HG3' ' A' ' 94' ' ' GLU . 45.1 p -119.23 28.8 8.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.677 179.015 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -52.66 120.98 13.16 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.222 -0.899 . . . . 0.0 113.75 -178.862 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.3 t -140.63 130.68 24.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.727 0.299 . . . . 0.0 110.334 178.895 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.46 -134.71 22.9 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.54 -0.838 . . . . 0.0 111.994 -179.463 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -93.85 -12.29 29.28 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.813 0.34 . . . . 0.0 110.541 179.698 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.568 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.8 -41.17 66.98 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.738 179.454 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -60.48 -56.64 18.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.051 179.86 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -48.56 -23.13 0.89 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.66 179.774 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.568 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 41.8 t -78.19 -55.83 9.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.646 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.704 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -52.93 -41.31 64.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.167 0.508 . . . . 0.0 112.206 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 85.2 t -64.89 -60.03 3.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.74 -178.318 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -65.54 -47.86 74.44 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.612 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.512 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 67.6 t80 -60.13 -22.63 63.08 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.666 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 4.6 mt -59.48 -20.83 58.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.602 -179.718 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -73.1 -9.7 59.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.338 -179.785 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 69.3 p -127.99 23.67 6.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.204 -179.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 26.4 m80 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.998 179.724 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.473 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.166 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.581 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 14.0 t80 -63.43 -44.84 93.43 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.46 ' HG3' ' NH1' ' A' ' 53' ' ' ARG . 3.2 mt-10 -53.39 -54.18 48.12 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.158 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.473 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 98.9 Cg_exo -43.11 -18.18 0.11 Allowed 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.719 2.279 . . . . 0.0 113.09 -179.998 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.8 mt -80.06 -58.15 3.29 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.323 179.724 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.6 -16.24 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.854 179.291 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -69.16 -30.96 69.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.621 178.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.4 t -66.45 -16.76 64.36 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.147 179.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.8 mt -62.42 -6.78 3.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.131 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.3 m -120.26 23.42 10.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.455 -179.566 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -90.15 150.52 21.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.33 -179.749 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -65.88 -35.17 79.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.031 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -75.96 156.48 34.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.206 -179.624 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -106.49 -33.94 7.54 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.098 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.459 ' HG3' HG13 ' A' ' 38' ' ' ILE . 33.2 ptt180 -59.79 -40.18 87.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.045 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.459 HG13 ' HG3' ' A' ' 37' ' ' ARG . 60.0 mt -77.69 -37.63 24.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.8 179.865 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -58.44 -22.96 56.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.379 179.416 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -78.88 -50.17 6.07 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.336 179.775 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.38 -34.25 23.5 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.836 0.35 . . . . 0.0 110.81 179.695 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.484 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -60.99 -55.14 36.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.202 179.291 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.19 -25.97 68.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.953 179.459 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.5 m95 -70.63 -37.43 73.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.234 -178.938 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.488 ' HA ' HD21 ' A' ' 48' ' ' ASN . 52.7 mt -99.17 -19.53 5.87 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-O 120.969 0.414 . . . . 0.0 111.755 -178.66 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.593 HG12 ' HA ' ' A' ' 54' ' ' ALA . 4.0 tt -56.82 -36.02 48.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.489 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.52 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -77.97 -22.15 69.45 Favored Glycine 0 CA--C 1.518 0.242 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.369 -178.996 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.488 HD21 ' HA ' ' A' ' 45' ' ' ILE . 36.2 m-80 -70.75 2.14 4.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.352 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.427 ' HB3' ' OD2' ' A' ' 51' ' ' ASP . 36.8 m-85 -107.97 -25.42 11.18 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.788 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.739 HE21 ' HA ' ' A' ' 80' ' ' ILE . 25.9 mp0 63.76 39.64 8.33 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.12 0.486 . . . . 0.0 110.942 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.427 ' OD2' ' HB3' ' A' ' 49' ' ' PHE . 2.8 m-20 -100.8 169.51 8.95 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.532 -179.499 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.481 ' O ' HG22 ' A' ' 55' ' ' VAL . 8.7 pt-20 -66.48 -40.39 89.3 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.423 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.46 ' NH1' ' HG3' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -69.34 -8.7 48.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.658 0.266 . . . . 0.0 110.741 179.806 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.593 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -87.84 -35.99 17.47 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.584 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.481 HG22 ' O ' ' A' ' 52' ' ' GLU . 35.1 m -64.5 -39.57 86.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -178.003 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.631 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 3.6 tp10 -59.44 -54.2 58.37 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -178.641 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.631 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 80.1 Cg_exo -46.34 -52.11 7.76 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.297 1.998 . . . . 0.0 112.476 179.62 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 73' ' ' ALA . 12.3 mt -53.65 -29.03 36.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.915 -179.14 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.0 mm -63.43 -60.73 2.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.43 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -70.1 -10.58 59.2 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -178.969 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.561 ' HG ' HG11 ' A' ' 69' ' ' VAL . 0.6 OUTLIER -83.02 -49.59 9.4 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.481 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.525 HD12 HD11 ' A' ' 77' ' ' LEU . 12.7 mt -56.39 -9.92 0.81 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.494 -179.311 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -123.78 -8.53 7.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.034 179.593 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -61.11 -38.83 87.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.074 0.464 . . . . 0.0 111.275 179.985 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.512 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 49.7 m-20 64.14 24.7 13.52 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.257 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.465 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.0 OUTLIER -83.91 7.64 17.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.291 -179.974 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.6 -78.32 0.73 Allowed Glycine 0 C--N 1.33 0.196 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.492 179.946 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -51.07 66.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.286 0.565 . . . . 0.0 109.969 179.422 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.561 HG11 ' HG ' ' A' ' 61' ' ' LEU . 21.8 t -62.63 -43.76 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.379 -179.8 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.512 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 37.8 ttp180 -66.77 -60.12 2.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.238 -179.686 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.0 m -51.51 -28.02 12.34 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.174 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -60.98 -46.01 95.44 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.184 179.702 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.507 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -66.96 -35.89 80.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.764 0.316 . . . . 0.0 111.085 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.17 -46.98 72.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.453 -179.691 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -78.88 -36.3 42.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.448 -179.688 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.52 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 58.8 m -59.37 -41.98 90.55 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.409 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.525 HD11 HD12 ' A' ' 62' ' ' LEU . 11.5 mt -61.1 -60.82 3.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.768 0.318 . . . . 0.0 110.718 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HA ' ' CD1' ' A' ' 107' ' ' TYR . 34.0 mt-10 -53.77 -33.24 55.22 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.557 178.726 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -63.2 -42.48 99.33 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.853 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.739 ' HA ' HE21 ' A' ' 50' ' ' GLN . 91.7 mt -64.32 -60.39 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.21 179.117 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.59 133.32 0.05 OUTLIER Glycine 0 CA--C 1.518 0.251 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.881 179.782 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 133.39 164.36 10.76 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.586 179.822 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.19 -22.43 66.9 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.782 0.325 . . . . 0.0 110.738 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.64 ' HD3' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -60.57 -53.42 57.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 -179.998 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.64 ' N ' ' HD3' ' A' ' 84' ' ' ARG . 2.3 t -70.81 -26.14 27.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.053 0.454 . . . . 0.0 110.245 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.492 ' HD2' ' HD1' ' A' ' 111' ' ' HIS . 74.2 ttt180 -52.44 -31.9 36.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.756 -179.84 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.11 92.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.393 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.09 -35.94 78.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.219 179.34 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.645 ' HE1' ' HA ' ' A' ' 104' ' ' ALA . 8.2 mmm -67.8 -43.08 80.51 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.568 179.05 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 14.4 mm-40 -57.39 -36.4 71.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.724 178.494 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -75.89 -28.74 58.23 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.29 179.771 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.435 HD22 HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -87.16 -23.24 24.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.935 0.398 . . . . 0.0 110.428 179.817 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.15 -29.88 70.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.382 -179.843 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.498 ' HG3' HG22 ' A' ' 95' ' ' THR . 11.3 pt-20 -80.22 -23.23 41.04 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.975 0.417 . . . . 0.0 110.291 179.741 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.498 HG22 ' HG3' ' A' ' 94' ' ' GLU . 73.9 p -111.87 19.63 17.75 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.794 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.579 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -52.18 119.67 9.55 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 114.952 -1.022 . . . . 0.0 113.306 -179.201 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.3 t -144.1 130.35 19.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.813 0.339 . . . . 0.0 111.007 179.205 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.63 -131.01 50.74 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.902 179.936 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -77.36 -27.76 52.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.722 0.296 . . . . 0.0 111.278 -179.792 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.43 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -53.93 -31.42 50.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.68 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.579 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 47.8 ttt180 -75.31 -52.46 10.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.373 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -48.22 -22.0 0.59 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.268 0.556 . . . . 0.0 110.454 179.651 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.493 HG13 ' HE3' ' A' ' 89' ' ' MET . 49.1 t -69.05 -60.17 2.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.524 179.738 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.645 ' HA ' ' HE1' ' A' ' 89' ' ' MET . . . -58.23 -46.97 84.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.179 0.514 . . . . 0.0 112.227 -179.596 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.403 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 59.5 t -64.88 -63.15 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -178.069 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -55.42 -37.3 67.48 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.199 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.56 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 22.9 t80 -61.5 -23.76 66.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.975 0.417 . . . . 0.0 111.421 -178.705 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 74.5 mt -58.1 -25.47 61.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.661 -179.478 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -85.38 0.45 52.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.522 -179.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 47.3 p -145.54 29.27 1.14 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -179.585 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.492 ' HD1' ' HD2' ' A' ' 86' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.153 -0.927 . . . . 0.0 111.043 179.927 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.628 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.23 0.07 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 . . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.531 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.9 t80 -59.14 -56.21 25.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.698 -179.693 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.439 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.41 -51.26 69.08 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-O 119.216 -0.421 . . . . 0.0 111.724 179.979 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.628 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 59.8 Cg_exo -39.23 -29.65 0.22 Allowed 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 122.285 1.99 . . . . 0.0 111.254 179.174 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.9 mt -73.85 -55.18 6.52 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.726 -1.124 . . . . 0.0 109.339 177.882 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.547 HD21 HD12 ' A' ' 31' ' ' LEU . 3.0 tm? -53.33 -46.52 69.5 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.844 178.538 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -62.72 -41.87 99.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.738 179.931 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.533 ' HA ' ' HB2' ' A' ' 33' ' ' ASN . 47.4 t -66.37 -12.27 55.91 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.061 -179.278 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.547 HD12 HD21 ' A' ' 28' ' ' LEU . 49.0 mt -57.44 -24.3 54.78 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.915 0.388 . . . . 0.0 110.688 -179.774 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 71.3 p -125.8 21.81 7.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.628 179.723 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.533 ' HB2' ' HA ' ' A' ' 30' ' ' SER . 26.3 t-20 -57.36 141.22 47.86 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.074 -179.747 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.25 -43.51 96.07 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.731 -179.948 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -77.95 137.64 38.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.593 179.526 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 21.3 m95 -76.86 -29.79 56.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.146 -179.661 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -62.97 -45.29 93.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.875 179.902 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.6 mm -67.37 -36.06 75.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.766 179.771 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.63 HH12 HD21 ' A' ' 61' ' ' LEU . 1.3 tpm_? -64.9 -34.52 78.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.636 179.738 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.17 -64.46 2.99 Favored Glycine 0 C--N 1.33 0.204 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.751 -179.873 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.32 -33.91 9.68 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.732 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.623 ' HB2' HH21 ' A' ' 39' ' ' ARG . . . -63.64 -56.35 16.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.78 0.324 . . . . 0.0 110.782 179.967 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.405 ' HB3' HD21 ' A' ' 61' ' ' LEU . . . -62.27 -26.05 68.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.077 179.539 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.9 m95 -70.55 -39.72 73.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.526 -178.762 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.8 mt -98.88 -19.08 6.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.842 0.353 . . . . 0.0 111.868 -178.515 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.516 HD12 ' HG2' ' A' ' 57' ' ' PRO . 5.4 tt -53.9 -36.44 30.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.044 -178.996 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.27 -17.58 74.27 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.179 -179.551 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.549 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.9 OUTLIER -70.33 -7.26 41.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.703 0.251 . . . . 0.0 111.58 -179.486 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -94.15 -24.92 17.34 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.598 0.237 . . . . 0.0 111.476 -179.905 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.625 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.7 mp0 60.74 30.28 19.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.382 179.485 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.438 ' O ' HG22 ' A' ' 55' ' ' VAL . 11.2 t70 -102.67 162.27 13.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.733 179.844 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -61.35 -36.23 79.63 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.011 -179.829 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 35.0 ttm180 -67.33 -9.61 42.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.026 0.441 . . . . 0.0 110.457 179.634 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.92 -7.99 21.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.558 -179.795 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 51' ' ' ASP . 21.4 t -90.22 -35.2 7.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.005 -179.769 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.509 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 20.6 tt0 -60.16 -48.44 94.31 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.341 -179.926 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.516 ' HG2' HD12 ' A' ' 46' ' ' ILE . 83.7 Cg_exo -46.18 -48.44 13.04 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 122.341 2.027 . . . . 0.0 112.094 179.365 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.502 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 1.7 mt -56.04 -33.06 64.62 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.8 -179.468 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 39.8 mm -57.16 -60.8 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.066 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.442 ' HZ1' ' HA ' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -70.24 -38.29 75.16 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.974 0.416 . . . . 0.0 111.826 -179.488 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.63 HD21 HH12 ' A' ' 39' ' ' ARG . 1.6 mp -57.08 -49.37 76.07 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -178.389 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.548 ' HB3' HD23 ' A' ' 92' ' ' LEU . 34.5 mt -60.44 -9.58 3.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.272 0.558 . . . . 0.0 110.008 -179.672 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -117.58 -12.0 10.39 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.843 179.511 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.47 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 6.5 t70 -61.05 -48.37 82.06 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.233 0.54 . . . . 0.0 111.152 -179.499 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.479 ' HB2' ' NH2' ' A' ' 70' ' ' ARG . 20.3 t70 68.98 21.39 7.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.806 179.447 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.455 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 36.2 m -86.22 12.14 10.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.265 -179.785 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.3 -100.78 1.42 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.614 179.712 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -46.27 -36.61 6.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.155 0.502 . . . . 0.0 110.512 179.762 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.573 HG12 ' HG ' ' A' ' 61' ' ' LEU . 16.4 t -73.57 -47.23 45.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.989 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.479 ' NH2' ' HB2' ' A' ' 65' ' ' ASP . 14.0 ttm180 -71.75 -61.76 1.66 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.651 0.263 . . . . 0.0 111.542 -179.48 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 87.6 p -50.56 -31.16 14.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.341 -179.706 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -62.66 -39.42 97.9 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.734 179.919 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.502 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -73.49 -30.03 62.89 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.599 0.238 . . . . 0.0 111.363 -179.983 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.8 -46.22 74.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.643 -179.591 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.1 ptp180 -79.28 -17.09 55.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.384 -179.716 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.0 t -63.82 -44.34 93.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.285 179.778 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.426 ' HA ' HG13 ' A' ' 85' ' ' VAL . 6.4 mp -58.95 -60.26 4.15 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.77 0.319 . . . . 0.0 111.138 179.997 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -50.92 -39.17 53.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.151 179.651 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -55.98 -38.37 70.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.339 -179.876 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.625 HG12 ' HG3' ' A' ' 50' ' ' GLN . 61.2 mt -86.95 -60.63 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.425 -179.767 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.82 93.81 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.512 -179.858 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.469 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 179.48 -174.16 45.96 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.779 -179.888 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -67.81 -31.93 72.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.891 0.376 . . . . 0.0 111.202 -179.7 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.56 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -60.44 -56.22 24.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.088 -179.814 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.56 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.6 OUTLIER -70.83 -20.69 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.839 0.352 . . . . 0.0 110.889 179.488 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.459 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 2.2 tmt_? -55.81 -31.98 63.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.801 179.404 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.412 ' O ' ' HG3' ' A' ' 90' ' ' GLU . . . -76.99 -23.94 52.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.865 179.801 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.24 -44.68 64.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.749 179.676 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.529 ' SD ' ' N ' ' A' ' 90' ' ' GLU . 2.3 ppp? -71.93 -30.58 65.48 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.276 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.529 ' N ' ' SD ' ' A' ' 89' ' ' MET . 1.0 OUTLIER -75.91 -29.19 58.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.936 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -72.05 -30.62 65.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.907 178.851 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.548 HD23 ' HB3' ' A' ' 62' ' ' LEU . 0.4 OUTLIER -87.33 -31.8 19.98 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.285 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.49 -24.98 61.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.408 178.807 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.21 -26.58 39.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.12 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 68.0 p -121.54 27.6 8.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.43 179.024 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -54.09 125.12 32.51 Favored Glycine 0 N--CA 1.448 -0.539 0 CA-C-N 115.086 -0.961 . . . . 0.0 113.683 -178.822 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.1 t -150.25 130.34 13.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.897 0.379 . . . . 0.0 111.033 179.129 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.22 -146.92 42.71 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.895 179.895 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.13 -28.71 62.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.672 0.272 . . . . 0.0 111.404 -179.805 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.527 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -55.25 -53.84 50.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.704 -179.79 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 39.4 ttp180 -55.24 -61.04 2.59 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.249 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 23.5 ttpp -45.67 -30.59 1.6 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.484 -179.174 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.527 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 4.8 t -65.06 -59.08 4.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.715 -179.82 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.39 -60.4 3.18 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.293 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 92.2 t -57.96 -61.24 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.447 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 12.0 m120 -55.49 -29.73 59.34 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.804 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -60.28 -33.07 71.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.135 0.493 . . . . 0.0 110.499 -179.899 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.42 ' HA ' ' HD1' ' A' ' 111' ' ' HIS . 74.5 mt -55.24 -13.43 1.31 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.865 -179.419 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.463 ' HG3' HG22 ' A' ' 110' ' ' THR . 9.0 pt-20 -78.42 5.22 11.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.553 -179.998 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 110' ' ' THR . . . . . 0.463 HG22 ' HG3' ' A' ' 109' ' ' GLU . 70.0 p -144.98 7.06 1.19 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.436 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.42 ' HD1' ' HA ' ' A' ' 108' ' ' LEU . 18.2 p-80 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.824 -179.993 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.42 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 CA--C 1.523 -0.079 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.09 -52.95 62.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 110.316 179.449 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -63.37 -54.98 39.56 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.19 179.703 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.42 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 43.7 Cg_exo -51.74 -19.49 7.94 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.754 1.636 . . . . 0.0 110.758 179.733 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.629 HD21 ' HA ' ' A' ' 46' ' ' ILE . 1.4 tp -87.05 -36.06 18.39 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.416 179.809 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.594 HD13 HD11 ' A' ' 31' ' ' LEU . 21.1 tp -81.94 -22.48 36.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.338 -179.942 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.91 -32.25 61.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.864 0.364 . . . . 0.0 110.998 -179.407 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 93.7 p -66.44 -20.05 65.95 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.41 -179.872 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.594 HD11 HD13 ' A' ' 28' ' ' LEU . 81.4 mt -66.19 -7.83 20.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.263 -179.824 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 98.2 p -106.91 21.82 16.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.826 179.769 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -84.7 142.99 29.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.08 -179.918 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -67.19 -17.53 64.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.597 179.746 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -86.36 156.63 20.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.659 179.835 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.9 p-90 -100.66 -34.29 9.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.427 -179.53 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -64.82 -44.74 88.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.774 0.321 . . . . 0.0 111.098 -179.901 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.4 mt -63.8 -42.92 97.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.717 -179.896 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -63.99 -21.63 66.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.553 179.765 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.12 -61.09 7.01 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.508 179.856 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.75 -34.77 28.49 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.737 0.303 . . . . 0.0 111.211 179.832 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.5 -56.72 18.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.709 179.729 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.37 -32.69 72.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.56 179.426 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.8 m95 -70.7 -29.33 65.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.466 -179.313 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.1 mt -99.02 -25.04 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-O 120.931 0.395 . . . . 0.0 111.574 -179.06 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.629 ' HA ' HD21 ' A' ' 27' ' ' LEU . 2.8 tt -60.55 -28.13 41.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.502 -178.792 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.533 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -66.23 -26.1 72.48 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.489 179.777 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.547 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.8 OUTLIER -53.14 -39.65 63.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.398 . . . . 0.0 110.159 179.615 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.414 ' C ' ' H ' ' A' ' 51' ' ' ASP . 24.8 m-85 -87.54 119.58 27.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.275 179.203 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.423 ' HG2' HG21 ' A' ' 80' ' ' ILE . 51.8 mt-30 -81.79 24.99 0.57 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.674 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.414 ' H ' ' C ' ' A' ' 49' ' ' PHE . 6.6 m-20 -83.94 163.09 20.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.096 -179.8 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.45 -25.97 66.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.183 -179.805 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.422 ' HD3' HD21 ' A' ' 28' ' ' LEU . 18.7 ttm180 -68.12 -12.81 61.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.759 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.57 -4.47 21.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 -179.374 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.5 t -83.76 -40.09 15.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.916 -179.091 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.475 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 2.1 tm-20 -60.21 -49.61 89.93 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 -179.643 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.475 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 92.8 Cg_exo -43.72 -52.3 5.45 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 122.244 1.963 . . . . 0.0 112.083 179.229 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 24.5 mt -49.82 -37.14 29.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.394 -0.821 . . . . 0.0 112.197 -179.81 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 44.7 mm -61.0 -62.09 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.07 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.423 ' HG3' HD13 ' A' ' 61' ' ' LEU . 5.3 pttt -72.71 -6.58 45.5 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.934 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.642 ' HG ' HG13 ' A' ' 69' ' ' VAL . 1.5 mp -89.03 -46.45 8.85 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -178.322 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.479 HD13 HD23 ' A' ' 92' ' ' LEU . 10.0 mt -60.76 -10.01 4.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.14 0.495 . . . . 0.0 110.377 -179.277 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -115.46 -14.98 11.54 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.146 -179.655 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -61.13 -31.59 71.3 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.124 0.488 . . . . 0.0 111.284 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.488 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 55.6 m-20 51.58 28.08 4.4 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.039 179.912 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.462 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 33.0 t -86.33 7.13 26.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.683 0.278 . . . . 0.0 111.27 179.903 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.59 -96.02 1.73 Allowed Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.296 -179.89 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -50.33 -43.63 54.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.128 0.49 . . . . 0.0 110.15 179.524 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.642 HG13 ' HG ' ' A' ' 61' ' ' LEU . 11.8 t -73.62 -46.23 48.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.864 -179.806 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.488 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 4.3 tmm_? -66.09 -64.03 0.95 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.549 -179.091 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.9 m -54.39 -27.1 34.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.608 179.827 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.6 -46.46 88.57 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.64 -0.79 . . . . 0.0 111.936 179.57 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.408 ' HB1' ' HB3' ' A' ' 61' ' ' LEU . . . -59.19 -56.09 26.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.581 0.229 . . . . 0.0 111.14 179.774 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -51.79 -27.0 10.87 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.07 0.462 . . . . 0.0 110.883 -179.562 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 34.8 ttt85 -80.31 -40.04 27.54 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.916 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.533 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 0.0 OUTLIER -67.08 -35.24 79.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.2 -178.966 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.5 mp -56.68 -59.06 5.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.654 0.264 . . . . 0.0 111.092 -179.663 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.43 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 44.7 mt-10 -49.0 -27.15 2.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.804 179.817 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -70.73 -43.61 68.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.779 0.323 . . . . 0.0 111.501 -179.86 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.423 HG21 ' HG2' ' A' ' 50' ' ' GLN . 46.7 mt -70.06 -61.28 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.8 -179.12 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 53.14 89.52 0.01 OUTLIER Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.498 -179.716 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.422 ' H ' ' CG1' ' A' ' 85' ' ' VAL . . . 178.33 -173.45 45.88 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.607 -179.623 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 86' ' ' ARG . 4.9 tm-20 -72.24 -25.8 61.77 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.781 0.324 . . . . 0.0 111.181 -179.691 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.563 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -70.0 -50.72 38.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.984 0.421 . . . . 0.0 110.499 179.839 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.563 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 11.5 p -70.66 -25.69 26.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.434 179.132 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.581 ' NH2' ' HA ' ' A' ' 108' ' ' LEU . 1.1 mmp_? -47.12 -40.08 14.74 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.152 179.635 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.11 -30.92 71.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.443 -179.389 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.36 -55.42 33.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.81 -179.796 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.549 ' HE1' ' HB3' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -68.3 -25.86 65.35 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.198 -179.389 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 42.5 mt-10 -73.02 -34.37 66.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.97 0.414 . . . . 0.0 109.995 179.133 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -78.92 -24.9 43.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.427 179.111 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.479 HD23 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -87.63 -30.19 20.64 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.203 179.323 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.27 -29.97 67.96 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.147 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.07 -26.57 39.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.15 0.5 . . . . 0.0 109.692 179.339 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.8 p -107.59 21.24 17.75 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.608 178.524 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.617 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -46.48 108.53 0.27 Allowed Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.124 -0.943 . . . . 0.0 112.751 -179.431 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 33.1 p -139.75 129.36 24.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.732 0.301 . . . . 0.0 110.727 -179.882 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 55.38 -145.02 32.11 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.858 -179.879 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -58.92 -30.46 67.86 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.715 0.293 . . . . 0.0 111.161 179.975 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.515 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -52.19 -42.59 63.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.852 -179.615 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.617 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 43.2 ttt180 -66.5 -55.6 14.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.676 0.274 . . . . 0.0 111.623 -179.535 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.2 tptp -46.05 -25.13 0.52 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.593 179.915 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.515 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 21.3 t -71.83 -58.43 5.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.912 -179.868 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.492 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -51.35 -60.88 2.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.819 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.523 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 21.8 t -56.58 -47.9 81.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -178.04 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -71.01 -35.01 71.89 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -179.52 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.43 ' CE1' ' HA ' ' A' ' 78' ' ' GLU . 14.1 t80 -64.11 -46.96 81.91 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.292 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.581 ' HA ' ' NH2' ' A' ' 86' ' ' ARG . 3.0 pp -55.34 -10.85 0.66 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.187 -178.882 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -89.11 6.96 37.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.52 0.2 . . . . 0.0 111.467 179.735 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.5 p -129.81 -66.54 0.79 Allowed 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.792 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.511 ' HB3' HH22 ' A' ' 86' ' ' ARG . 21.4 p80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 117.949 -1.024 . . . . 0.0 111.331 -179.266 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.945 0.402 . . . . 0.0 110.795 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.525 ' HZ ' ' HB3' ' A' ' 54' ' ' ALA . 1.4 t80 -63.53 -45.28 91.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.444 179.95 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.439 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 24.2 mt-10 -63.37 -55.63 33.97 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.018 -179.653 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 9.4 Cg_endo -54.93 -16.1 11.2 Favored 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 121.74 1.626 . . . . 0.0 110.704 179.344 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.452 ' HB3' ' O ' ' A' ' 24' ' ' PHE . 1.0 OUTLIER -85.62 -34.31 21.43 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.461 -1.245 . . . . 0.0 108.881 178.842 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.499 HD13 HD11 ' A' ' 31' ' ' LEU . 0.7 OUTLIER -77.32 -39.26 48.4 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.988 178.869 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -64.52 -37.14 86.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.214 -179.308 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 89.4 p -66.33 -14.56 62.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.945 -179.172 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.499 HD11 HD13 ' A' ' 28' ' ' LEU . 96.5 mt -60.15 -29.15 68.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.747 0.308 . . . . 0.0 111.154 -179.893 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.9 m -92.46 20.88 5.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.667 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.706 HD22 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -75.3 150.56 38.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.851 179.995 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -67.05 -20.7 65.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.304 -179.807 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.418 ' HB2' ' OD1' ' A' ' 33' ' ' ASN . 7.5 m-20 -78.65 162.98 25.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.893 0.378 . . . . 0.0 111.052 -179.821 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -104.57 -44.43 4.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.829 -179.7 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.496 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 71.4 mtp85 -58.83 -58.36 8.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.663 -179.703 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.455 ' HB ' ' OD1' ' A' ' 33' ' ' ASN . 71.1 mt -50.05 -40.6 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.496 -179.582 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.706 ' HB2' HD22 ' A' ' 33' ' ' ASN . 43.1 ttp180 -64.41 -40.22 95.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.012 179.896 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -59.8 -58.86 12.0 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.285 179.952 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.66 -28.81 6.34 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.683 0.278 . . . . 0.0 111.173 179.675 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.24 -56.37 23.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.721 179.702 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.586 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -64.24 -32.47 74.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.611 179.445 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.422 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 12.6 m95 -55.72 -32.02 62.98 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.959 179.926 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.444 ' HA ' HD21 ' A' ' 48' ' ' ASN . 50.9 mm -98.51 -24.52 4.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.61 179.507 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.586 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 5.6 mm -55.43 -44.59 76.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.654 -179.979 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.34 -22.75 59.15 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.796 -0.716 . . . . 0.0 113.214 -179.397 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.444 HD21 ' HA ' ' A' ' 45' ' ' ILE . 44.1 m-80 -68.42 -40.55 81.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.81 0.305 . . . . 0.0 111.445 -179.797 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -97.15 112.22 24.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.718 0.294 . . . . 0.0 110.452 -179.929 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.648 ' H ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -77.22 58.14 1.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.767 179.762 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -102.7 172.69 6.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.935 -179.526 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -66.25 -45.47 80.44 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.876 -179.307 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -6.92 13.26 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.244 -0.183 . . . . 0.0 111.118 179.893 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.525 ' HB3' ' HZ ' ' A' ' 24' ' ' PHE . . . -95.65 8.92 42.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.011 0.434 . . . . 0.0 111.042 -178.752 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 45.4 t -92.01 -59.11 3.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.558 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.401 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 27.3 tt0 -60.29 -49.64 89.63 Favored Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.495 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.455 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 58.4 Cg_exo -38.23 -44.88 2.06 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.709 2.273 . . . . 0.0 113.391 -179.088 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 73' ' ' ALA . 8.0 mt -62.55 -54.05 45.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.321 -179.369 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 83.1 mt -50.53 -53.95 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.048 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -24.27 63.13 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -177.956 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.547 ' HG ' HG13 ' A' ' 69' ' ' VAL . 3.7 tp -90.13 -20.0 23.63 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -178.716 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.649 HD12 HD11 ' A' ' 92' ' ' LEU . 6.3 mt -69.5 -12.59 61.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.937 0.399 . . . . 0.0 110.635 -179.916 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -112.68 1.73 15.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.978 -179.893 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -61.15 -30.35 70.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.165 0.507 . . . . 0.0 110.642 179.759 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.538 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 26.3 m-20 48.63 27.6 1.54 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.135 -0.939 . . . . 0.0 112.279 179.628 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.468 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 38.6 t -86.32 -15.06 41.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.765 0.316 . . . . 0.0 110.677 179.808 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 118.0 -109.94 1.9 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.504 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.496 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -59.15 -25.42 63.87 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.659 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.547 HG13 ' HG ' ' A' ' 61' ' ' LEU . 41.4 t -71.18 -32.29 47.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.645 178.61 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.538 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 52.8 ttp180 -78.7 -44.39 23.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.698 179.422 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.451 ' HA ' ' HZ ' ' A' ' 99' ' ' PHE . 28.9 t -67.09 -41.73 85.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.452 -179.83 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -51.18 -45.83 51.6 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.417 -179.79 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.575 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . . . -71.75 -31.79 67.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.649 0.262 . . . . 0.0 111.048 179.68 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.586 ' HA ' HD22 ' A' ' 62' ' ' LEU . . . -60.17 -54.22 48.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.755 -179.224 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -61.88 -27.5 68.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.328 -179.645 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.415 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 50.4 m -58.87 -33.98 71.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.127 -179.831 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.569 HD11 HD11 ' A' ' 62' ' ' LEU . 9.1 mp -61.25 -60.64 3.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.89 0.376 . . . . 0.0 110.441 179.455 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -55.84 -24.95 39.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.295 178.909 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.415 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 37.8 mt-30 -70.73 -50.91 31.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.741 179.767 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.541 ' HB ' HG22 ' A' ' 85' ' ' VAL . 74.3 mt -66.03 -60.79 2.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.057 -179.984 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.64 127.46 0.02 OUTLIER Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.621 179.913 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 145.06 178.04 20.33 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.848 179.775 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.53 -34.35 78.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.846 0.355 . . . . 0.0 110.714 -179.99 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.476 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -57.72 -47.82 81.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.942 -179.881 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.541 HG22 ' HB ' ' A' ' 80' ' ' ILE . 33.1 t -70.56 -26.33 28.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.419 . . . . 0.0 110.648 179.654 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -58.61 -23.13 58.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.671 -179.895 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.9 -27.97 26.26 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.193 0.52 . . . . 0.0 109.771 179.434 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.98 -40.03 83.2 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.213 179.049 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.518 ' HE1' HD22 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.2 -36.96 74.95 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.656 179.181 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.46 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 35.9 mt-10 -57.86 -32.72 67.94 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.623 178.876 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.8 tmtm? -64.56 -52.65 56.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.736 179.57 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.649 HD11 HD12 ' A' ' 62' ' ' LEU . 54.4 mt -61.83 -37.59 85.01 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.717 0.294 . . . . 0.0 110.712 -179.915 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.405 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -54.58 -31.03 56.06 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.179 0.514 . . . . 0.0 110.282 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -86.66 -21.93 26.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.013 179.425 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.2 p -118.01 38.15 3.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.122 -179.869 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.406 ' HA2' ' HB2' ' A' ' 101' ' ' ARG . . . -39.4 109.36 0.11 Allowed Glycine 0 C--N 1.334 0.448 0 CA-C-N 116.092 -0.504 . . . . 0.0 113.198 -179.78 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.1 t -151.88 138.55 18.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.834 0.349 . . . . 0.0 111.459 -179.888 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 55.09 -139.24 41.35 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.81 179.673 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.451 ' HZ ' ' HA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -94.76 -13.97 25.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.843 0.354 . . . . 0.0 110.6 -179.903 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.416 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -56.37 -35.02 67.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.829 179.824 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.406 ' HB2' ' HA2' ' A' ' 96' ' ' GLY . 11.0 tpt180 -61.74 -60.27 3.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.335 179.486 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.502 ' HG3' ' ND2' ' A' ' 106' ' ' ASN . 32.2 ttpt -51.55 -32.62 28.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.022 179.277 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.514 HG12 ' HB3' ' A' ' 74' ' ' ALA . 22.7 t -64.57 -46.87 91.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.97 179.484 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.516 ' HB3' HD13 ' A' ' 92' ' ' LEU . . . -61.49 -51.92 66.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.977 -179.562 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 59.9 t -63.62 -60.9 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.273 -179.022 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.502 ' ND2' ' HG3' ' A' ' 102' ' ' LYS . 17.3 m-80 -57.26 -30.08 64.36 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.744 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.03 -29.44 67.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.165 0.507 . . . . 0.0 110.039 -179.892 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.518 HD22 ' HE1' ' A' ' 89' ' ' MET . 98.0 mt -55.61 -25.29 37.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.011 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -51.26 -34.97 35.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.9 p -95.99 -57.0 2.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.329 179.994 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.959 179.993 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.406 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.231 0.117 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 . . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.432 ' HZ ' ' HB1' ' A' ' 54' ' ' ALA . 1.3 t80 -60.93 -48.01 83.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.24 -179.917 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -55.26 36.61 Favored Pre-proline 0 C--N 1.33 -0.249 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.238 179.775 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.406 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 52.5 Cg_exo -49.73 -26.34 13.12 Favored 'Trans proline' 0 C--N 1.357 1.019 0 C-N-CA 121.726 1.617 . . . . 0.0 110.458 179.022 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.542 HD12 HD12 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -76.93 -42.51 39.08 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.554 179.186 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.542 HD13 HD13 ' A' ' 31' ' ' LEU . 11.7 tp -76.16 -17.15 59.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.04 178.937 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -74.53 -32.16 62.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.744 -179.79 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.475 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 71.6 m -66.41 -22.48 66.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.235 -179.779 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.665 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 93.6 mt -67.01 -9.54 40.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.81 0.338 . . . . 0.0 110.851 179.942 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.4 t -112.42 19.57 17.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.8 179.853 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.475 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 77.0 m-20 -89.82 147.53 23.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.212 -179.974 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -66.23 -23.05 66.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.772 179.835 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -78.01 149.18 34.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.935 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.6 p90 -93.28 -38.45 11.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.861 180.0 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.427 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 72.9 mtt-85 -60.4 -54.08 49.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.314 179.693 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.3 mm -54.57 -40.88 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.589 -179.359 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.665 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 39.7 ttm180 -65.46 -27.34 68.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.381 -179.774 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.474 ' HA2' HG11 ' A' ' 69' ' ' VAL . . . -64.4 -63.0 4.61 Favored Glycine 0 N--CA 1.453 -0.183 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.546 -179.782 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.57 -22.69 0.3 Allowed 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 179.995 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.422 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.5 -57.31 13.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.727 0.298 . . . . 0.0 110.924 179.85 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.97 -24.89 66.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.922 0.392 . . . . 0.0 110.805 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -61.85 -39.2 91.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.394 -179.925 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 33.5 mm -100.93 -21.62 5.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-O 120.831 0.348 . . . . 0.0 111.8 -179.521 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.542 HD12 HD12 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -54.52 -38.01 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.265 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.3 -20.6 79.6 Favored Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 120.507 -0.854 . . . . 0.0 113.205 -178.979 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.8 -0.8 9.77 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.383 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.426 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 91.0 m-85 -103.68 -34.01 8.76 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.716 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.426 ' HB2' ' O ' ' A' ' 49' ' ' PHE . 16.8 mt-30 67.31 57.27 0.59 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.245 0.545 . . . . 0.0 110.976 179.9 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -128.26 164.72 21.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.041 -179.803 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -65.48 -32.48 74.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.149 0.5 . . . . 0.0 110.098 179.355 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -69.3 -9.65 54.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.806 179.81 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.499 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -104.68 2.16 30.18 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.997 -179.378 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.2 t -86.57 -47.72 16.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.444 -179.416 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.475 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 23.2 tt0 -60.35 -47.76 95.67 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.788 -179.838 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.475 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 98.7 Cg_exo -43.68 -42.7 11.56 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.589 2.193 . . . . 0.0 113.002 -179.622 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.54 HD13 HD13 ' A' ' 77' ' ' LEU . 11.3 mt -64.66 -39.79 94.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.057 -179.874 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.6 mm -54.57 -57.66 5.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.981 -179.564 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.2 tmmm? -70.07 -28.46 65.45 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -178.353 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 4.7 tp -89.62 -21.39 22.83 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -177.521 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.585 HD11 HD23 ' A' ' 92' ' ' LEU . 22.4 mt -67.19 -20.81 65.77 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.584 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -92.41 -11.38 35.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.676 178.764 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.402 ' OD2' ' HB ' ' A' ' 69' ' ' VAL . 11.9 t70 -52.27 145.76 10.38 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.883 -178.523 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -118.29 27.0 9.23 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.021 -179.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.505 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 27.0 t -86.44 -36.38 19.13 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.898 -179.903 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 126.76 -96.72 0.47 Allowed Glycine 0 N--CA 1.452 -0.263 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.921 -179.603 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.427 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -61.48 -26.97 68.25 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.104 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.505 ' HB ' ' HB3' ' A' ' 66' ' ' SER . 32.2 t -67.95 -36.48 75.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.106 178.999 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -74.04 -55.3 6.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.358 179.549 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 36.8 t -59.07 -25.76 64.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.929 179.833 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.59 -45.6 89.87 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.367 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.525 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . . . -70.04 -30.28 67.52 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.863 0.363 . . . . 0.0 110.674 179.664 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.75 -53.04 61.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.897 -179.439 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -66.22 -22.53 66.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.682 -179.152 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.542 ' HA ' HE21 ' A' ' 79' ' ' GLN . 40.4 t -58.59 -32.84 69.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.488 -179.645 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.569 HD21 ' HE2' ' A' ' 89' ' ' MET . 7.2 mp -55.38 -62.27 1.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.503 -179.82 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.455 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 42.2 mt-10 -55.42 -32.84 63.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.255 179.563 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.542 HE21 ' HA ' ' A' ' 76' ' ' SER . 22.7 mt-30 -70.7 -27.17 63.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.165 -179.961 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 76' ' ' SER . 96.7 mt -83.16 -59.02 3.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.769 -179.284 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.629 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . -179.56 -116.37 0.51 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.034 -1.079 . . . . 0.0 113.411 -179.516 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.436 ' O ' ' HB2' ' A' ' 86' ' ' ARG . . . -157.91 -71.02 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 121.208 -0.52 . . . . 0.0 112.022 -179.972 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.4 ' HG3' ' NH2' ' A' ' 86' ' ' ARG . 43.1 tt0 -72.24 -21.83 61.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.864 0.364 . . . . 0.0 111.244 -179.922 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.629 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.0 OUTLIER -75.58 -56.97 4.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.206 -178.912 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' ' SD ' ' A' ' 89' ' ' MET . 0.4 OUTLIER -68.3 -29.94 46.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.413 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 33.1 ttp180 -41.83 -35.05 0.74 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.921 -179.401 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.83 -49.37 75.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.872 0.368 . . . . 0.0 110.764 -179.877 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.44 -34.54 74.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.859 179.588 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.612 ' HG3' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -60.64 -48.45 81.71 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.18 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 46.7 mt-10 -56.13 -35.6 67.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.425 178.051 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -76.54 -25.86 54.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.979 179.753 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.585 HD23 HD11 ' A' ' 62' ' ' LEU . 0.9 OUTLIER -84.46 -24.98 29.26 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.774 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.71 -28.05 68.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.894 178.904 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -80.24 -25.66 39.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.258 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.8 p -109.42 17.18 21.72 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.433 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.543 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -54.49 116.82 6.89 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 114.7 -1.136 . . . . 0.0 113.311 -179.079 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.3 t -142.41 132.14 24.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.861 0.362 . . . . 0.0 110.958 179.258 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.26 -124.72 35.51 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.559 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.442 ' O ' HG23 ' A' ' 103' ' ' VAL . 68.5 t80 -79.91 -29.99 39.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.881 0.372 . . . . 0.0 110.37 179.583 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.407 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.79 -36.11 35.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.483 179.837 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.543 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 23.4 ttt180 -70.4 -61.11 1.9 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.655 -179.535 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -47.8 -22.27 0.52 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.238 -179.492 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 99' ' ' PHE . 39.2 t -63.53 -60.27 3.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.792 -179.916 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.612 ' HA ' ' HG3' ' A' ' 89' ' ' MET . . . -57.99 -62.35 1.88 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.224 0.535 . . . . 0.0 112.431 -179.203 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.404 HG11 ' H ' ' A' ' 106' ' ' ASN . 3.1 p -52.68 -56.81 5.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.227 -0.897 . . . . 0.0 113.267 -178.294 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.404 ' H ' HG11 ' A' ' 105' ' ' VAL . 55.1 t30 -59.97 -35.38 74.87 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -178.813 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.547 ' HD2' ' HG2' ' A' ' 89' ' ' MET . 30.2 t80 -61.8 -25.48 67.52 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.98 0.419 . . . . 0.0 110.688 -179.323 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 99.3 mt -58.95 -13.18 5.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.592 179.694 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -64.98 -7.24 10.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.604 179.84 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 73.0 p -93.12 -49.82 5.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.648 179.64 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.884 179.486 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.478 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.182 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 . . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.409 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 1.9 t80 -57.99 -52.38 65.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.717 -179.028 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.451 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 2.8 mt-10 -62.63 -57.17 23.63 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.674 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 13.9 Cg_endo -57.41 -12.03 9.82 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 122.112 1.875 . . . . 0.0 111.892 -179.729 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.617 HD23 ' HA ' ' A' ' 46' ' ' ILE . 1.9 tp -84.89 -44.3 13.31 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.96 179.899 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 pp -84.34 -16.34 43.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.693 178.733 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -71.76 -31.38 66.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.086 179.566 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 t -66.35 -19.09 65.71 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.122 179.986 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.583 HD11 ' HB3' ' A' ' 57' ' ' PRO . 91.5 mt -57.14 -16.77 8.49 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.856 0.36 . . . . 0.0 111.03 -179.926 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 74.6 m -94.7 23.46 5.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.224 -179.94 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.502 HD22 ' HB2' ' A' ' 39' ' ' ARG . 2.2 p30 -85.37 147.48 26.49 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.819 0.342 . . . . 0.0 110.583 -179.728 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -66.95 -25.89 66.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.143 -178.885 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -82.72 163.54 21.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.35 . . . . 0.0 111.082 -179.798 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.406 ' HB2' ' HG ' ' A' ' 66' ' ' SER . 67.7 p-90 -101.75 -35.68 8.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.141 179.965 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.497 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 67.9 ttt180 -62.78 -29.74 70.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.35 -179.78 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.1 mt -76.5 -48.98 25.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.785 0.326 . . . . 0.0 111.256 -179.793 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.502 ' HB2' HD22 ' A' ' 33' ' ' ASN . 31.5 ttm180 -55.69 -27.83 52.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.254 -179.715 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.642 ' HA2' HD22 ' A' ' 61' ' ' LEU . . . -67.68 -55.68 13.78 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.744 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.13 -29.67 14.18 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.774 0.321 . . . . 0.0 111.245 179.793 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.456 ' O ' HD12 ' A' ' 27' ' ' LEU . . . -57.73 -54.37 47.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.851 179.797 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.52 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -68.43 -29.3 67.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.008 179.943 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.6 m95 -59.94 -38.04 81.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.626 -179.899 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.1 mm -98.87 -19.49 5.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.837 0.351 . . . . 0.0 111.718 -179.776 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.617 ' HA ' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -52.74 -44.03 46.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.009 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.97 -13.51 83.09 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.69 -0.767 . . . . 0.0 113.701 -178.748 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.528 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.9 OUTLIER -70.77 -3.5 19.11 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 -179.37 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -99.59 -30.4 12.15 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.27 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.429 ' HG3' HG13 ' A' ' 80' ' ' ILE . 1.1 tt0 71.0 51.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.135 0.493 . . . . 0.0 111.029 179.284 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -127.45 155.71 43.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.13 -179.97 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.41 ' H ' ' CD ' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -63.51 -30.3 71.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.664 179.734 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.405 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 38.0 ttt180 -69.22 -10.11 56.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.96 179.738 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.576 ' HB2' HG21 ' A' ' 46' ' ' ILE . . . -94.54 11.96 29.08 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -179.032 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.41 HG21 ' O ' ' A' ' 52' ' ' GLU . 23.0 m -91.68 -42.15 13.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.359 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.578 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 6.5 tp10 -60.34 -50.31 86.42 Favored Pre-proline 0 C--N 1.327 -0.378 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.667 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.583 ' HB3' HD11 ' A' ' 31' ' ' LEU . 52.3 Cg_exo -53.67 -23.54 26.46 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.262 1.975 . . . . 0.0 112.88 -179.271 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.488 HD22 ' HA ' ' A' ' 73' ' ' ALA . 57.2 mt -84.99 -40.69 16.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.09 -179.58 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.563 ' HA ' HD11 ' A' ' 62' ' ' LEU . 49.9 mm -58.88 -43.33 88.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.837 -179.536 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -70.03 -26.65 64.14 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -178.821 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.642 HD22 ' HA2' ' A' ' 40' ' ' GLY . 5.2 tp -88.97 -29.07 19.81 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -178.21 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.62 HD12 HD13 ' A' ' 77' ' ' LEU . 15.5 mt -58.66 -19.16 36.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.975 0.417 . . . . 0.0 110.565 179.153 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -111.93 -0.93 15.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.162 -179.882 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.506 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 6.2 t70 -61.25 -36.95 81.38 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.408 0.623 . . . . 0.0 110.482 -179.849 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 10.8 m-20 56.7 25.67 10.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.522 179.296 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.448 ' HB2' ' OD1' ' A' ' 64' ' ' ASP . 0.3 OUTLIER -80.5 -27.75 37.66 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 121.057 0.456 . . . . 0.0 109.959 179.262 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 131.9 -103.64 0.54 Allowed Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.554 179.709 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.497 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -58.34 -24.31 59.37 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 117.041 0.42 . . . . 0.0 109.949 179.855 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.0 m -70.24 -40.19 77.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 121.231 0.539 . . . . 0.0 109.774 178.495 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.457 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 50.5 ttp180 -71.12 -44.96 64.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.542 179.921 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.4 p -67.16 -35.08 78.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.87 179.469 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.475 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -62.22 -55.8 25.74 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.647 -179.736 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.488 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -58.08 -39.5 78.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.899 0.381 . . . . 0.0 110.714 179.749 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.466 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.89 -46.07 90.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.512 -179.76 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.475 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 0.2 OUTLIER -70.85 -32.64 69.73 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.423 -179.041 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.453 ' HB2' HD22 ' A' ' 58' ' ' LEU . 46.5 m -61.79 -34.44 75.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.806 0.336 . . . . 0.0 110.996 -179.791 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.62 HD13 HD12 ' A' ' 62' ' ' LEU . 66.5 mt -59.64 -60.65 3.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.977 0.418 . . . . 0.0 110.62 179.576 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -65.34 -18.18 65.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.641 179.456 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.425 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 8.7 tt0 -56.88 -39.93 75.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.91 -179.897 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.429 HG13 ' HG3' ' A' ' 50' ' ' GLN . 3.2 mp -80.43 -56.77 5.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.928 179.584 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.461 ' HA2' ' HH ' ' A' ' 107' ' ' TYR . . . 71.03 58.56 5.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.339 -179.781 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -135.13 179.84 17.27 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.304 179.786 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.08 -22.1 64.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.809 0.338 . . . . 0.0 110.836 179.957 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.539 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -76.9 -31.42 56.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.786 -179.271 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.539 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 38.2 t -70.31 -33.76 55.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.915 0.388 . . . . 0.0 110.195 179.412 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.8 ttp180 -56.26 -21.93 26.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.062 179.961 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.33 -33.86 37.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.688 179.928 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.18 -31.03 68.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.971 179.805 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.541 ' HE2' ' HA ' ' A' ' 104' ' ' ALA . 10.0 mmm -72.21 -50.03 30.67 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.306 179.866 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.43 -35.62 65.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.168 179.4 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.45 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 11.7 tmtt? -70.27 -31.73 69.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.866 179.853 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.592 HD23 HD13 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -85.99 -28.62 24.09 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 179.845 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.46 -28.91 60.94 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.849 178.83 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -80.18 -27.76 38.86 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.077 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.3 p -109.35 25.96 11.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.68 178.827 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.489 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -49.75 113.06 1.64 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.45 -178.983 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 58.2 m -141.1 130.4 23.63 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.181 -0.304 . . . . 0.0 110.181 179.435 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.26 -130.27 12.23 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.063 -179.381 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -95.82 -15.82 22.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.732 0.301 . . . . 0.0 110.839 179.939 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.451 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -51.71 -42.89 62.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.437 -179.749 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.489 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 60.5 ttt180 -59.29 -60.7 3.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.01 -179.969 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.6 tttp -49.91 -24.33 2.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.25 0.548 . . . . 0.0 110.333 179.621 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.1 t -79.82 -48.56 20.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.388 179.943 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.579 ' HB3' HD22 ' A' ' 92' ' ' LEU . . . -58.62 -53.08 62.35 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.258 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 28.3 t -64.91 -58.99 4.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.917 -178.084 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -55.59 -38.61 69.63 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.519 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.496 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 36.7 t80 -63.34 -25.22 68.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.829 0.347 . . . . 0.0 111.231 -178.805 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 94.0 mt -56.37 -20.13 17.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.543 -179.785 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -78.56 6.23 9.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.603 -179.416 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.0 p -138.9 -53.46 0.58 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.469 179.917 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.8 p-80 . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.43 -179.788 . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.645 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 CA--C 1.522 -0.123 0 CA-C-O 120.773 0.32 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.499 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 1.9 t80 -56.49 -64.82 0.74 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.725 179.798 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.497 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.36 -50.8 72.4 Favored Pre-proline 0 C--N 1.329 -0.314 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 179.563 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.645 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 53.9 Cg_exo -45.81 -25.06 2.36 Favored 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 121.933 1.756 . . . . 0.0 110.826 179.706 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.648 HD22 HG13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -82.62 -47.08 12.49 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.364 178.921 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.26 -39.33 78.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.13 178.443 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -59.81 -29.07 67.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.393 -179.21 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.9 m -64.98 -22.43 67.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.581 -179.356 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.435 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 68.0 mt -69.55 -11.74 61.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.054 -179.844 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.3 t -109.65 13.09 23.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.705 179.889 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -78.55 135.68 37.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.031 -179.862 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -58.22 -26.84 63.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.207 -179.986 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -84.84 130.85 34.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.046 179.993 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -84.04 -27.74 28.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.729 179.809 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.8 mtp180 -62.51 -42.11 99.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.585 179.537 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.4 mt -79.89 -31.57 13.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.768 179.952 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.435 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 35.6 ttm180 -65.53 -36.21 83.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.626 179.732 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -57.34 -48.81 77.67 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.072 179.818 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.31 -35.86 68.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.7 0.285 . . . . 0.0 110.944 179.611 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.407 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.7 -53.2 59.5 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.424 179.514 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.37 90.8 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.454 179.126 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.664 ' HA ' ' NH1' ' A' ' 75' ' ' ARG . 7.9 m95 -63.62 -28.55 70.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.013 -179.233 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.7 mm -98.95 -24.07 4.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.921 0.391 . . . . 0.0 111.108 179.839 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.648 HG13 HD22 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -60.84 -30.97 48.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.847 -179.315 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.5 ' HA3' HH21 ' A' ' 75' ' ' ARG . . . -61.26 -28.99 70.12 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.86 -179.744 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -59.84 -26.2 65.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.85 0.357 . . . . 0.0 110.399 179.857 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.433 ' C ' ' H ' ' A' ' 51' ' ' ASP . 47.0 m-85 -94.94 111.72 23.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.486 179.847 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -80.27 36.72 0.37 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.461 179.831 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.459 ' O ' HG23 ' A' ' 55' ' ' VAL . 20.6 m-20 -102.34 158.18 16.38 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.789 -179.698 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.72 -33.75 75.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.798 -179.189 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 18.8 ttm180 -65.84 -13.44 59.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.951 0.405 . . . . 0.0 110.558 -180.0 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.42 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -105.15 -3.03 23.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.353 179.97 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 51' ' ' ASP . 93.2 t -91.21 -34.26 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.277 -179.907 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.465 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 20.9 tt0 -60.36 -44.85 97.06 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 116.272 -0.422 . . . . 0.0 112.077 -179.864 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.473 ' O ' HD12 ' A' ' 61' ' ' LEU . 94.6 Cg_exo -45.53 -53.0 6.0 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.437 2.091 . . . . 0.0 113.578 -179.548 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.52 HD11 ' HA ' ' A' ' 73' ' ' ALA . 0.1 OUTLIER -54.27 -30.32 50.2 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.965 0.358 . . . . 0.0 111.965 -178.864 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 43.5 mm -55.12 -59.06 2.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.736 0.303 . . . . 0.0 111.584 -179.557 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -70.06 -37.16 75.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.802 -179.518 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.518 ' HG ' HG11 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -52.54 -55.55 21.38 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.91 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.55 HD22 HD22 ' A' ' 92' ' ' LEU . 9.3 mt -51.76 -13.92 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.609 -179.729 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -113.11 -19.15 11.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.024 179.857 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.426 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 7.9 t0 -61.18 -34.56 75.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.005 0.431 . . . . 0.0 111.422 -179.773 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.651 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 14.4 m-20 54.85 29.64 12.36 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.317 -179.707 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.479 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.0 t -83.18 0.29 46.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.383 -179.973 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.61 -78.19 1.67 Allowed Glycine 0 C--O 1.228 -0.237 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.199 -179.665 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.95 -45.2 94.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.158 0.504 . . . . 0.0 109.818 179.32 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.518 HG11 ' HG ' ' A' ' 61' ' ' LEU . 10.7 t -73.63 -46.68 47.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.514 -179.839 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.651 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 14.0 ttp180 -63.35 -59.23 4.97 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -179.357 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.4 t -50.91 -32.78 21.74 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.98 -179.353 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.552 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -54.24 -47.66 67.11 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.817 179.479 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.52 ' HA ' HD11 ' A' ' 58' ' ' LEU . . . -51.04 -32.39 21.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.656 0.265 . . . . 0.0 111.558 179.9 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.94 -60.98 2.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.686 -179.226 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.669 HH21 HE22 ' A' ' 79' ' ' GLN . 0.2 OUTLIER -61.42 -27.92 68.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.711 -179.397 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.403 ' HB2' ' NH2' ' A' ' 75' ' ' ARG . 39.3 t -62.15 -52.67 62.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.726 0.298 . . . . 0.0 111.51 -179.663 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.475 ' HA ' HG11 ' A' ' 85' ' ' VAL . 8.3 mp -55.72 -60.72 3.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.645 -179.83 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -55.57 -24.65 33.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.968 0.413 . . . . 0.0 110.566 179.644 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.669 HE22 HH21 ' A' ' 75' ' ' ARG . 2.0 mt-30 -70.87 -48.25 54.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.132 179.806 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 79.5 mt -71.97 -60.71 2.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.4 -179.494 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.434 ' N ' HG23 ' A' ' 85' ' ' VAL . . . 67.75 121.33 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.729 -179.943 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.496 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 146.11 179.72 22.51 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.762 179.935 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -66.06 -31.72 72.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.919 0.39 . . . . 0.0 110.603 -179.97 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.564 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.59 -52.31 64.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.069 -179.744 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.564 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.1 OUTLIER -70.37 -22.88 24.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.981 0.419 . . . . 0.0 110.518 179.693 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -58.63 -22.15 55.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.382 179.503 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.69 -32.26 57.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.317 179.602 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.23 -48.8 77.91 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.982 179.156 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.536 ' HB3' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -72.12 -24.43 61.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.556 179.115 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.504 ' HG2' ' HE3' ' A' ' 89' ' ' MET . 19.8 mm-40 -66.74 -35.05 79.19 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.999 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -81.49 -28.84 33.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.815 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.55 HD22 HD22 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -85.67 -35.03 21.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.605 0.24 . . . . 0.0 110.864 -179.288 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -55.55 -28.47 55.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.963 0.411 . . . . 0.0 110.496 179.104 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.22 -26.17 39.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.386 179.934 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 50.0 p -117.6 30.96 6.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.615 179.2 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.43 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -53.35 121.55 17.45 Favored Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 115.186 -0.915 . . . . 0.0 113.539 -178.999 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.417 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 29.4 m -154.13 130.27 10.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.833 0.349 . . . . 0.0 110.682 179.124 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.04 -158.45 25.35 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.904 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -55.35 -33.18 63.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.608 0.242 . . . . 0.0 111.247 179.972 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.554 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -48.55 -48.05 38.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.316 -179.913 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.454 ' HA ' HD13 ' A' ' 92' ' ' LEU . 72.0 ttt180 -60.23 -58.35 8.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.994 -179.618 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.518 ' HD2' HD22 ' A' ' 106' ' ' ASN . 4.6 tppp? -45.89 -24.91 0.45 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.381 -179.08 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.554 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 40.3 t -68.37 -52.98 31.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.367 179.763 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.536 ' HA ' ' HB3' ' A' ' 89' ' ' MET . . . -53.41 -63.03 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.499 0.666 . . . . 0.0 112.375 -179.374 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.47 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 32.8 t -52.18 -62.83 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.779 -1.1 . . . . 0.0 113.412 -178.355 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.518 HD22 ' HD2' ' A' ' 102' ' ' LYS . 98.4 m-20 -55.45 -34.22 64.29 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -178.236 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -59.42 -28.53 67.02 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-O 120.987 0.422 . . . . 0.0 111.145 -179.031 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 15.2 mt -62.13 -14.99 42.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.61 179.949 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -79.36 5.81 11.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.863 -179.411 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 35.5 p -146.63 -34.19 0.29 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.734 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 40.8 m80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.293 -179.125 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.848 0.356 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.466 ' HZ ' ' HB1' ' A' ' 54' ' ' ALA . 15.0 t80 -63.3 -37.15 86.15 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.151 0.501 . . . . 0.0 110.425 179.86 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.408 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 1.1 mp0 -63.28 -57.68 19.36 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.998 179.759 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.408 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.5 Cg_endo -56.08 -14.5 11.7 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 121.484 1.456 . . . . 0.0 110.13 179.235 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.444 ' HB3' ' O ' ' A' ' 24' ' ' PHE . 0.7 OUTLIER -86.86 -37.45 17.7 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.285 -1.325 . . . . 0.0 109.089 178.451 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.495 HD23 HD21 ' A' ' 31' ' ' LEU . 3.4 tm? -75.96 -31.41 59.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.824 179.459 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -71.31 -15.47 62.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.416 179.917 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 65.2 m -66.45 -51.5 56.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.14 -179.125 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.495 HD21 HD23 ' A' ' 28' ' ' LEU . 2.4 pp -60.45 -7.71 2.26 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.7 0.286 . . . . 0.0 111.527 -179.329 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.9 m -88.93 19.71 3.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.85 0.357 . . . . 0.0 110.449 179.529 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -105.08 150.57 24.89 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.094 179.951 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -67.38 -12.37 60.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.678 179.526 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -76.0 153.57 36.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.651 -179.929 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.3 m95 -102.78 -32.81 9.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.082 -179.7 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.494 ' HG3' HG13 ' A' ' 38' ' ' ILE . 34.0 ptt180 -62.0 -39.49 92.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.938 179.981 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.494 HG13 ' HG3' ' A' ' 37' ' ' ARG . 40.9 mt -82.22 -32.32 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.999 0.428 . . . . 0.0 110.517 179.475 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.56 ' HD2' HG11 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -58.37 -38.83 78.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.302 -179.988 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.53 -53.97 7.07 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.879 -179.462 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.41 -39.14 46.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.709 0.29 . . . . 0.0 111.76 -179.912 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.4 -33.45 75.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.24 -179.759 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.435 ' HB1' HD22 ' A' ' 61' ' ' LEU . . . -85.44 -28.88 24.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.383 -179.88 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.0 m95 -69.53 -31.54 69.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.267 -178.778 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.563 ' HA ' HD21 ' A' ' 48' ' ' ASN . 22.8 mt -99.29 -19.43 5.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.981 0.42 . . . . 0.0 111.199 -179.246 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.57 HG12 ' HA ' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -51.17 -27.53 6.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.826 -179.346 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -93.11 -22.67 26.9 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.111 -179.084 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.563 HD21 ' HA ' ' A' ' 45' ' ' ILE . 37.7 m-80 -69.84 -12.07 61.34 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 -179.589 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -101.94 -35.66 8.91 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.747 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 69.61 72.06 0.24 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 0.0 110.843 179.622 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -126.68 170.53 12.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.277 179.876 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.446 ' O ' HG21 ' A' ' 55' ' ' VAL . 0.5 OUTLIER -66.43 -38.84 88.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.623 -179.292 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.45 ' HB2' ' HE1' ' A' ' 24' ' ' PHE . 0.2 OUTLIER -69.2 -9.98 55.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -179.614 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.57 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -88.59 10.61 19.88 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.902 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.446 HG21 ' O ' ' A' ' 52' ' ' GLU . 27.4 m -92.47 -49.21 13.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.851 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.504 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -60.42 -51.95 76.41 Favored Pre-proline 0 CA--C 1.533 0.297 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.963 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.504 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 71.8 Cg_exo -41.56 -53.06 3.43 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 122.404 2.069 . . . . 0.0 112.536 -179.898 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.584 HD21 ' HG ' ' A' ' 76' ' ' SER . 8.4 mt -52.1 -47.87 65.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.693 -179.399 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 51.2 mt -54.76 -56.91 8.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.208 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.633 ' HZ2' ' HB2' ' A' ' 60' ' ' LYS . 0.1 OUTLIER -69.68 -16.2 63.31 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -178.876 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.666 ' HG ' HG13 ' A' ' 69' ' ' VAL . 0.6 OUTLIER -88.85 -46.26 9.08 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.303 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.508 ' HB2' HD23 ' A' ' 92' ' ' LEU . 7.1 mt -59.61 -15.06 16.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.176 0.512 . . . . 0.0 110.208 -179.306 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -112.31 -11.71 13.67 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.281 179.322 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.495 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 7.1 t70 -61.32 -32.12 71.98 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.772 -179.758 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.618 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 1.3 m-20 57.09 27.18 12.99 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.583 -179.82 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.493 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.5 t -85.55 -3.35 58.84 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.161 -179.941 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.83 -73.34 2.57 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.503 179.914 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -70.32 -43.53 70.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.022 0.439 . . . . 0.0 110.029 179.536 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.666 HG13 ' HG ' ' A' ' 61' ' ' LEU . 4.7 t -73.83 -33.49 37.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.386 179.949 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.618 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 62.5 ttt180 -77.49 -53.58 7.45 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.128 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.465 ' O ' ' HG3' ' A' ' 75' ' ' ARG . 90.8 p -50.8 -55.45 16.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.572 -178.949 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -45.35 -32.3 3.71 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 121.202 -0.523 . . . . 0.0 113.071 -179.553 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.447 ' HB3' ' HA ' ' A' ' 58' ' ' LEU . . . -69.47 -48.83 59.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.646 0.26 . . . . 0.0 111.179 179.94 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.65 -35.77 66.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.283 -179.616 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.465 ' HG3' ' O ' ' A' ' 71' ' ' SER . 8.8 mtp85 -74.27 -34.04 63.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.319 179.874 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.711 ' HA ' HE21 ' A' ' 79' ' ' GLN . 31.0 t -61.44 -37.02 82.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.709 -179.318 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.443 HD12 HD11 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -59.95 -60.2 4.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.648 0.261 . . . . 0.0 111.072 179.944 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.44 -29.36 67.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.262 179.486 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.711 HE21 ' HA ' ' A' ' 76' ' ' SER . 21.4 mt-30 -70.67 -36.86 73.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.758 0.313 . . . . 0.0 110.761 179.647 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 94.2 mt -80.3 -61.51 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.528 -179.692 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.44 122.47 0.01 OUTLIER Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.664 -179.846 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.425 ' O ' ' HG3' ' A' ' 86' ' ' ARG . . . 145.91 171.02 15.05 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.624 -179.992 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.4 ' HA ' ' HD2' ' A' ' 86' ' ' ARG . 36.0 tt0 -62.63 -26.97 68.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.643 0.258 . . . . 0.0 111.384 -179.752 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.525 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -62.22 -49.26 76.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.028 0.442 . . . . 0.0 110.288 179.785 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.525 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.1 OUTLIER -70.85 -23.73 24.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.16 179.947 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 82' ' ' GLY . 98.5 mtt180 -58.64 -27.76 65.03 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.871 0.367 . . . . 0.0 110.558 179.533 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.34 -29.09 63.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.145 179.585 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.36 -45.39 63.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.843 179.738 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.491 ' HB2' ' HB3' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.29 -33.08 71.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.886 0.374 . . . . 0.0 110.26 179.562 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.96 -34.67 76.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.921 178.915 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -61.0 -40.77 94.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.978 179.223 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.508 HD23 ' HB2' ' A' ' 62' ' ' LEU . 66.1 mt -71.21 -38.54 72.03 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.988 179.836 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.437 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -52.76 -27.7 19.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.441 179.84 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -97.49 -10.49 25.25 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 -179.404 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.466 ' OG1' ' HA ' ' A' ' 92' ' ' LEU . 47.4 p -106.16 -31.42 8.69 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.72 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.565 ' HA2' ' HD3' ' A' ' 101' ' ' ARG . . . 52.67 92.9 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.877 -179.866 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.419 ' H ' ' HB2' ' A' ' 101' ' ' ARG . 79.7 m -140.24 129.23 23.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.39 . . . . 0.0 111.575 179.934 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.432 ' HA3' HH22 ' A' ' 70' ' ' ARG . . . 38.72 -127.88 1.88 Allowed Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.548 -0.751 . . . . 0.0 113.767 179.498 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -92.81 -21.88 19.64 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.479 0.18 . . . . 0.0 110.982 -179.703 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.604 ' H ' HH21 ' A' ' 70' ' ' ARG . . . -49.93 -40.03 42.21 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.009 0.433 . . . . 0.0 110.654 179.815 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.565 ' HD3' ' HA2' ' A' ' 96' ' ' GLY . 30.7 tpt85 -57.27 -61.56 2.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.639 179.508 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -55.66 -39.55 71.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.155 179.392 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.3 t -60.88 -36.69 73.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.112 179.901 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.491 ' HB3' ' HB2' ' A' ' 89' ' ' MET . . . -63.42 -60.95 2.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.858 -179.169 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.554 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 58.6 t -60.89 -40.49 85.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.844 -179.205 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -71.1 -28.66 64.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.823 179.743 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -63.51 -50.31 70.11 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -177.8 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 3.2 pp -52.33 -13.32 0.33 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.496 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -78.05 5.91 8.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.962 0.41 . . . . 0.0 110.715 179.335 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.5 m -124.47 -59.6 1.45 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.08 179.94 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 53.1 p-80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.442 179.807 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.474 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.231 0.105 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 . . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.529 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -63.2 -49.68 73.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.026 0.441 . . . . 0.0 110.649 179.933 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -63.32 -53.43 53.17 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.116 179.838 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.474 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 83.7 Cg_exo -41.73 -24.57 0.27 Allowed 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 122.327 2.018 . . . . 0.0 111.961 179.554 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.529 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 70.2 mt -75.91 -57.02 4.12 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.473 178.997 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.53 HD13 HD11 ' A' ' 31' ' ' LEU . 28.5 tp -62.86 -24.56 67.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.101 179.938 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.2 -45.93 37.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 -179.598 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.2 p -63.29 -15.02 55.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.348 -179.8 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.53 HD11 HD13 ' A' ' 28' ' ' LEU . 57.0 mt -63.7 -10.96 22.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.84 0.352 . . . . 0.0 111.03 179.982 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.7 t -95.82 23.33 6.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.679 179.864 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.533 HD22 ' HB2' ' A' ' 39' ' ' ARG . 1.3 p30 -88.7 148.06 24.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.95 -179.614 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -65.6 -29.25 69.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.534 -179.386 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -77.88 163.63 25.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 0.0 111.066 -179.782 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -105.04 -24.94 12.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.594 -179.879 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 56.0 mtm180 -60.9 -39.13 88.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.193 179.736 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.7 mt -79.0 -45.57 24.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.453 -179.508 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.533 ' HB2' HD22 ' A' ' 33' ' ' ASN . 32.0 ttm180 -59.51 -41.3 89.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.23 -179.52 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.619 ' HA2' HD21 ' A' ' 61' ' ' LEU . . . -65.09 -62.84 4.59 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.001 -179.534 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.92 -24.74 2.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.745 0.307 . . . . 0.0 111.187 179.984 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.414 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -63.07 -55.01 29.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.758 179.465 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.02 -22.51 64.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.957 0.408 . . . . 0.0 110.716 179.71 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.3 m95 -56.91 -47.11 81.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.588 -179.967 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.457 ' N ' HD12 ' A' ' 45' ' ' ILE . 4.4 mp -99.5 -20.69 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.0 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.602 HG22 ' HB1' ' A' ' 54' ' ' ALA . 4.1 tt -55.43 -39.21 52.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -178.269 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.502 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -75.45 -11.44 84.29 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.512 -179.079 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -70.69 -10.98 60.63 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.149 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -95.59 -4.19 45.01 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.403 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.508 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.9 OUTLIER 46.41 56.27 6.54 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 179.494 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -127.3 151.29 48.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.893 0.377 . . . . 0.0 110.886 179.723 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -59.8 -22.9 62.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.833 179.717 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.44 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -65.82 -30.64 71.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.643 179.685 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.602 ' HB1' HG22 ' A' ' 46' ' ' ILE . . . -102.18 30.54 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.471 -178.967 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.441 ' CG1' ' N ' ' A' ' 56' ' ' GLU . 9.9 p -91.39 -54.33 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.62 -179.964 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.479 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 10.5 tt0 -61.0 -49.7 87.89 Favored Pre-proline 0 CA--C 1.536 0.406 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.797 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 81.5 Cg_exo -43.53 -36.73 7.26 Favored 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.5 2.133 . . . . 0.0 113.023 -179.313 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.525 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . 27.5 mt -71.24 -47.14 59.0 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.07 -179.658 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.416 ' HA ' HD22 ' A' ' 62' ' ' LEU . 25.3 mt -59.4 -49.38 83.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.969 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.08 -26.81 64.17 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -177.759 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.619 HD21 ' HA2' ' A' ' 40' ' ' GLY . 21.8 tp -90.08 -30.62 17.58 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -178.236 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.525 HD22 HD23 ' A' ' 92' ' ' LEU . 4.0 pp -68.49 -8.9 45.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.121 0.486 . . . . 0.0 110.703 -179.124 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -112.32 0.27 15.64 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.018 179.298 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -61.92 -31.76 72.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.793 -179.668 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.442 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 14.6 t70 59.77 24.8 13.76 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.684 179.576 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.38 -20.61 43.65 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.028 0.442 . . . . 0.0 110.076 179.392 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 128.45 -110.03 1.08 Allowed Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.726 179.49 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -56.86 -23.97 48.19 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.846 0.355 . . . . 0.0 110.084 -179.949 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.542 ' HB ' HD11 ' A' ' 61' ' ' LEU . 3.7 m -69.15 -37.33 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-O 121.35 0.595 . . . . 0.0 110.013 179.298 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' A' ' 62' ' ' LEU . 3.8 ttm180 -63.0 -53.52 52.71 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.529 179.776 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 72.1 m -67.17 -38.7 85.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.424 179.935 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -52.53 -61.76 6.42 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.617 -179.668 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.525 ' HB3' ' HA ' ' A' ' 58' ' ' LEU . . . -59.06 -34.76 72.33 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.684 0.278 . . . . 0.0 111.073 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.2 -58.04 9.96 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.964 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 10.2 ptp180 -55.09 -34.39 63.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.507 -179.02 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.584 ' HA ' HE21 ' A' ' 79' ' ' GLN . 49.9 m -57.16 -34.03 68.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.641 0.258 . . . . 0.0 111.192 179.963 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.4 mp -60.47 -61.08 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.753 0.311 . . . . 0.0 110.977 179.592 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.413 ' HG2' ' HB2' ' A' ' 107' ' ' TYR . 42.9 mt-10 -64.47 -19.23 65.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.274 0.559 . . . . 0.0 110.102 179.073 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.584 HE21 ' HA ' ' A' ' 76' ' ' SER . 8.7 tt0 -70.78 -29.45 65.66 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.705 179.929 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.524 ' HB ' HG22 ' A' ' 85' ' ' VAL . 85.3 mt -84.52 -60.18 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.103 179.961 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.5 123.43 0.04 OUTLIER Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.623 179.908 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 137.45 172.88 12.69 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.576 179.802 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.25 -22.07 27.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.006 0.431 . . . . 0.0 111.074 179.826 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.5 ' HD3' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.94 -63.09 1.37 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.302 -179.872 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.524 HG22 ' HB ' ' A' ' 80' ' ' ILE . 20.3 t -70.67 -21.11 22.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.991 179.687 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.455 ' HA ' ' SD ' ' A' ' 89' ' ' MET . 68.3 mtt180 -53.31 -24.16 11.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.769 -179.529 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.87 -36.47 28.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.409 179.197 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.52 -39.33 70.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.872 -179.987 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.492 ' SD ' ' HB3' ' A' ' 108' ' ' LEU . 19.1 ptt? -63.75 -38.8 92.45 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -179.745 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -68.05 -26.49 65.88 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.446 178.656 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? -72.36 -41.94 65.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.483 179.403 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.525 HD23 HD22 ' A' ' 62' ' ' LEU . 8.8 mt -65.37 -38.42 89.98 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.604 179.917 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.75 -29.65 40.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.734 179.556 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -83.19 -24.62 32.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.352 179.049 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.3 p -114.58 31.49 6.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.178 179.367 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.503 ' HA2' ' HB2' ' A' ' 101' ' ' ARG . . . -45.96 99.15 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.698 -0.683 . . . . 0.0 113.291 -179.355 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.7 m -146.78 130.74 17.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.738 0.304 . . . . 0.0 110.28 179.618 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.87 -144.97 33.15 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.436 -0.888 . . . . 0.0 111.685 -179.386 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.45 -16.01 22.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.782 0.325 . . . . 0.0 110.547 179.604 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.407 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -55.79 -29.47 59.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.456 179.701 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.503 ' HB2' ' HA2' ' A' ' 96' ' ' GLY . 16.0 tpt180 -67.36 -57.67 6.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.996 178.844 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -49.38 -34.7 16.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.955 179.004 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.407 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 38.5 t -61.25 -55.45 24.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.15 179.785 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.501 ' HB3' HD12 ' A' ' 92' ' ' LEU . . . -56.18 -61.64 2.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.859 -179.277 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.479 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 45.1 t -50.76 -52.91 15.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.943 -179.304 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -71.13 -19.66 62.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.305 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.432 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 3.0 t80 -64.31 -51.83 61.49 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -177.721 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.492 ' HB3' ' SD ' ' A' ' 89' ' ' MET . 1.9 pp -52.07 -14.99 0.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.076 -178.982 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -72.41 3.33 4.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.727 0.299 . . . . 0.0 110.62 179.56 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.1 p -141.51 -47.95 0.39 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.268 -179.845 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 43.7 p-80 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.518 -179.971 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.478 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 120.94 0.4 . . . . 0.0 110.497 . . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.583 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 4.2 t80 -63.45 -39.49 94.61 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.951 -179.962 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -57.27 -55.13 47.49 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.228 -179.312 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 91.8 Cg_exo -37.54 -30.24 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 C-N-CA 122.627 2.218 . . . . 0.0 111.997 179.079 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.583 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 22.7 mt -71.28 -58.71 3.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.828 179.212 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.542 ' HA ' HD11 ' A' ' 31' ' ' LEU . 41.9 tp -62.8 -21.45 65.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.896 179.997 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -79.55 -47.76 14.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.669 -179.905 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.8 m -66.41 -13.3 60.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.76 -179.758 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.542 HD11 ' HA ' ' A' ' 28' ' ' LEU . 46.8 mt -62.59 -10.27 11.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.658 0.266 . . . . 0.0 111.344 -179.733 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 35.9 m -89.96 6.88 40.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.893 179.933 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.72 HD22 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -83.4 141.01 32.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.145 0.498 . . . . 0.0 111.327 -179.827 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.88 -9.57 45.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.855 -179.745 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -78.61 147.53 33.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.815 0.34 . . . . 0.0 111.108 -179.495 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.8 p-90 -98.62 -37.31 9.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.345 -179.792 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.2 tpt180 -59.51 -43.26 93.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.167 -179.877 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.7 mt -78.07 -49.48 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.219 -179.784 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.72 ' HB2' HD22 ' A' ' 33' ' ' ASN . 42.8 ttp180 -54.87 -30.92 59.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.853 179.824 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.09 -58.92 6.25 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.52 -179.926 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.56 -27.73 2.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.774 0.321 . . . . 0.0 111.329 -179.942 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.43 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.32 -51.96 66.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 179.797 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.516 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -73.17 -31.01 63.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.174 179.867 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.6 m95 -55.92 -37.64 69.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.441 -179.632 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.5 mt -99.56 -22.91 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.078 0.466 . . . . 0.0 110.907 -179.626 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.545 HG23 ' HB3' ' A' ' 54' ' ' ALA . 0.0 OUTLIER -51.35 -39.56 21.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.33 -178.853 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -76.86 -25.7 64.09 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.655 -0.783 . . . . 0.0 113.767 -178.868 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -70.82 -2.05 13.6 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -178.769 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.437 ' HB2' ' HE2' ' A' ' 24' ' ' PHE . 22.4 m-30 -112.71 -12.47 13.37 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.437 -0.505 . . . . 0.0 112.2 -179.449 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.505 ' HG2' HG21 ' A' ' 80' ' ' ILE . 0.6 OUTLIER 53.21 68.93 0.76 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.796 0.332 . . . . 0.0 111.212 179.331 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -127.48 164.25 22.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.869 0.366 . . . . 0.0 111.026 179.963 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -63.34 -43.72 96.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.78 179.564 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -6.53 21.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.29 -179.991 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.545 ' HB3' HG23 ' A' ' 46' ' ' ILE . . . -93.89 1.44 56.36 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.037 0.446 . . . . 0.0 111.041 -178.926 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.7 t -91.34 -49.13 13.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.24 -178.728 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 43.6 tt0 -60.23 -48.79 93.27 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.105 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.455 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 93.6 Cg_exo -43.06 -42.93 9.66 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.381 2.054 . . . . 0.0 112.873 -179.878 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.454 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 4.0 mt -66.35 -36.68 83.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.265 -179.284 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 29.2 mm -59.45 -59.03 4.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.192 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -70.05 -20.79 63.22 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.355 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.638 ' HG ' ' HB ' ' A' ' 69' ' ' VAL . 5.3 mp -83.38 -46.06 12.99 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -178.385 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.9 mt -61.37 -10.9 8.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.091 0.472 . . . . 0.0 110.5 -179.338 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.75 -17.05 13.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.285 179.126 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -62.09 -38.84 90.4 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.936 -179.68 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.57 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 5.3 m-20 57.74 27.39 14.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.712 -179.947 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.81 -25.67 59.18 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.003 0.43 . . . . 0.0 110.326 179.557 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 120.7 -82.12 0.34 Allowed Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.408 179.861 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.74 -33.23 75.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.295 0.569 . . . . 0.0 109.613 179.179 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.638 ' HB ' ' HG ' ' A' ' 61' ' ' LEU . 3.2 m -71.91 -42.14 69.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.473 -179.767 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.57 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 25.7 ttp180 -75.48 -47.57 26.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.076 -179.172 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 46.6 t -58.81 -50.29 74.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.482 179.605 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.9 -51.04 56.13 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.918 179.486 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.454 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -56.52 -33.42 66.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.673 0.273 . . . . 0.0 110.977 179.364 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.91 -54.19 45.39 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.54 -179.546 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -69.76 -19.5 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.732 -179.589 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.535 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 59.8 m -58.74 -47.59 84.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.576 -179.863 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.451 ' HA ' HG22 ' A' ' 85' ' ' VAL . 6.3 mp -56.44 -54.9 40.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.846 -179.973 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.447 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 47.0 mt-10 -49.07 -34.0 12.76 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.422 179.463 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.535 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 18.9 mt-30 -69.91 -41.62 74.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.015 -179.997 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.505 HG21 ' HG2' ' A' ' 50' ' ' GLN . 88.4 mt -69.3 -61.02 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.943 179.645 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.49 113.83 0.01 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.119 -0.562 . . . . 0.0 112.989 179.658 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 156.01 175.2 26.73 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.781 179.709 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.26 -23.34 61.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.841 0.353 . . . . 0.0 110.802 179.724 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.638 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.83 -45.48 61.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.046 -179.796 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.638 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 8.8 p -71.05 -26.47 27.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.231 0.538 . . . . 0.0 110.647 179.761 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.486 ' HG3' ' HE1' ' A' ' 89' ' ' MET . 6.1 ttt180 -53.76 -28.76 36.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.798 179.581 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.18 -32.12 73.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.717 179.71 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.18 -57.89 10.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.343 -179.972 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.584 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.15 -24.61 65.0 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.822 -179.886 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.402 ' N ' ' SD ' ' A' ' 89' ' ' MET . 2.1 tm-20 -63.89 -44.19 93.77 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.119 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -72.22 -22.22 61.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.114 179.533 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.494 HD23 ' O ' ' A' ' 100' ' ' ALA . 0.3 OUTLIER -86.57 -28.54 23.25 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 120.81 0.338 . . . . 0.0 110.269 179.978 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.0 -19.15 65.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.948 179.667 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -84.56 -24.9 29.04 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.177 179.619 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 42.5 p -120.38 19.06 12.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.893 179.101 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -49.75 121.27 9.02 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.271 -179.263 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.6 t -142.59 130.66 21.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.842 0.354 . . . . 0.0 110.987 179.556 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.85 -136.53 46.42 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.677 -179.943 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.434 ' O ' HG22 ' A' ' 103' ' ' VAL . 48.1 t80 -66.25 -34.86 78.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.786 0.327 . . . . 0.0 111.012 179.997 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.494 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -51.59 -33.84 34.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.979 -179.59 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.0 ttp180 -72.63 -55.36 6.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.512 -179.408 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -49.25 -21.64 0.86 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.233 0.54 . . . . 0.0 110.484 179.722 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 55.2 t -71.01 -58.77 4.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.609 179.81 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.584 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.88 -47.57 82.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.276 0.56 . . . . 0.0 112.368 -179.278 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.521 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 40.2 t -64.91 -51.5 65.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.342 -0.844 . . . . 0.0 112.878 -178.042 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -64.0 -45.36 89.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.671 0.272 . . . . 0.0 111.519 -179.248 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.447 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 61.1 t80 -60.44 -22.55 63.56 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.68 -179.049 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.521 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.0 OUTLIER -55.13 -18.11 5.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.089 179.884 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -71.47 -1.3 12.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.813 179.691 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 4.0 m -145.45 32.75 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.443 -179.981 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.1 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.961 179.84 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.603 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.463 0.178 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 . . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.568 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -52.25 -50.17 62.59 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.975 0.417 . . . . 0.0 110.463 179.553 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -63.36 -57.87 18.31 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.802 179.636 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.603 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 74.6 Cg_exo -43.73 -30.88 3.1 Favored 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 122.077 1.851 . . . . 0.0 111.554 179.795 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.568 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 36.6 mt -62.8 -56.85 13.75 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.354 178.918 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.482 HD23 ' HB2' ' A' ' 53' ' ' ARG . 0.9 OUTLIER -69.82 -19.6 63.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.126 179.515 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -73.33 -39.57 65.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.781 179.552 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.0 m -66.42 -7.18 17.7 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.116 179.778 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.479 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 96.4 mt -61.24 -19.87 62.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.914 0.388 . . . . 0.0 110.479 179.626 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 83.4 p -92.51 12.05 24.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.074 179.968 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -72.55 139.15 47.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.777 -179.762 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.39 -31.78 73.03 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.855 -179.942 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -77.39 147.97 35.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.495 179.782 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 25.8 p-90 -89.44 -40.24 12.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.463 -179.473 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -60.28 -25.52 65.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.913 0.387 . . . . 0.0 110.723 179.756 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.3 mm -81.08 -47.77 19.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.087 179.974 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.479 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 49.4 ttp180 -63.73 -22.08 66.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.877 179.901 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.452 ' HA2' ' HA ' ' A' ' 69' ' ' VAL . . . -69.04 -59.16 6.09 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.606 -179.885 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.26 -20.37 1.04 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.704 0.288 . . . . 0.0 111.597 180.0 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.86 -55.09 37.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.354 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.563 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -73.81 -25.47 60.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.175 -179.959 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.7 m95 -55.46 -36.95 67.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.211 -179.586 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.0 mt -100.1 -26.14 3.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.039 0.447 . . . . 0.0 111.128 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.563 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 0.9 OUTLIER -56.3 -46.61 81.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.34 -178.873 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.35 -21.61 60.08 Favored Glycine 0 CA--C 1.518 0.281 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.391 -179.058 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -70.71 -20.9 62.62 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 -179.064 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -92.08 -28.78 16.92 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.142 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.72 27.31 14.71 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 179.367 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.491 ' O ' HG23 ' A' ' 55' ' ' VAL . 12.0 t70 -96.12 170.03 9.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.767 0.317 . . . . 0.0 111.272 -179.866 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -54.12 -52.09 62.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.038 179.672 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.482 ' HB2' HD23 ' A' ' 28' ' ' LEU . 3.2 ptt180 -61.6 -8.47 4.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.225 179.66 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.487 ' HB3' HG23 ' A' ' 46' ' ' ILE . . . -104.97 -21.0 13.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.92 0.391 . . . . 0.0 111.067 -179.691 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 51' ' ' ASP . 69.5 t -73.58 -54.17 16.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.694 -179.633 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.435 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 25.5 tt0 -54.21 -47.7 96.57 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -179.527 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.494 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 97.2 Cg_exo -42.08 -46.92 7.02 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 122.489 2.126 . . . . 0.0 112.561 179.623 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.557 HD13 HD22 ' A' ' 77' ' ' LEU . 6.1 mt -63.48 -42.34 98.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.938 -179.592 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.0 mm -51.46 -54.84 10.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.345 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -70.06 -47.89 60.09 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.278 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.57 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.1 mp -60.17 -40.55 90.35 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.054 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.535 HD11 HD23 ' A' ' 77' ' ' LEU . 37.2 mt -56.77 -15.71 5.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.287 0.565 . . . . 0.0 109.999 -179.555 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -99.57 -30.98 11.83 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.293 178.235 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -62.21 87.77 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.174 178.957 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.467 ' HA ' ' NE ' ' A' ' 70' ' ' ARG . 16.6 m-20 -73.91 41.91 0.13 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.246 -178.798 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.9 t -85.75 -30.82 22.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.782 0.325 . . . . 0.0 111.125 179.763 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 126.46 -106.54 0.85 Allowed Glycine 0 C--O 1.228 -0.267 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.996 -179.686 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -46.7 -29.73 2.03 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.631 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.57 HG12 ' HG ' ' A' ' 61' ' ' LEU . 47.0 t -68.19 -54.98 18.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.963 179.559 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.467 ' NE ' ' HA ' ' A' ' 65' ' ' ASP . 0.2 OUTLIER -66.79 -54.69 20.07 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.257 179.736 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.3 m -50.95 -31.3 17.37 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.536 -179.614 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.46 -46.12 95.0 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.429 179.922 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.43 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -70.21 -32.94 71.06 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 -179.837 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.34 -61.53 2.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.817 0.342 . . . . 0.0 111.648 -179.189 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 75' ' ' ARG . 6.4 ptp180 -60.68 -20.48 61.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.746 -179.425 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.608 ' HA ' HE21 ' A' ' 79' ' ' GLN . 50.2 m -67.15 -36.03 80.96 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.27 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.557 HD22 HD13 ' A' ' 58' ' ' LEU . 4.2 mm? -54.81 -61.05 2.56 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.724 0.297 . . . . 0.0 111.416 179.748 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.469 ' HG2' ' HD1' ' A' ' 107' ' ' TYR . 37.6 mt-10 -56.36 -41.28 75.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.889 179.567 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.608 HE21 ' HA ' ' A' ' 76' ' ' SER . 20.3 mt-30 -62.32 -40.96 98.06 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -178.772 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 72.9 mt -60.74 -59.77 3.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -179.176 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.4 ' H ' HG21 ' A' ' 85' ' ' VAL . . . 174.59 -124.92 1.05 Allowed Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.09 -1.053 . . . . 0.0 113.392 179.938 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.455 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . -146.64 -66.67 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.411 -0.899 . . . . 0.0 113.748 -179.099 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.59 -27.08 63.83 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.335 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.482 ' HG2' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -85.05 -48.34 9.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.863 0.363 . . . . 0.0 110.517 -179.277 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.551 HG12 HD11 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -70.85 -20.77 22.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.723 178.858 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 1.4 tmm_? -47.28 -29.66 2.6 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.637 179.088 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.74 -36.84 50.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.75 179.963 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.91 -47.64 84.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.919 179.615 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 89' ' ' MET . . . . . 0.582 ' HE1' ' HG3' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -67.6 -30.29 69.84 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.509 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.582 ' HG3' ' HE1' ' A' ' 89' ' ' MET . 22.1 mt-10 -66.49 -33.89 76.71 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.122 179.171 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -70.72 -38.67 73.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.113 179.788 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.499 HD23 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -82.05 -23.66 35.74 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.652 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.31 -26.36 68.73 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.298 179.024 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -80.22 -26.76 38.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.708 179.887 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 58.3 p -112.54 23.02 14.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.171 178.54 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.446 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -56.07 116.1 6.92 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.064 -0.971 . . . . 0.0 113.508 -178.958 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.8 t -147.79 130.32 15.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.741 0.305 . . . . 0.0 110.72 179.05 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.07 -142.19 48.41 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.734 -179.833 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -62.54 -29.45 70.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 111.009 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.436 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -56.24 -37.63 70.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.505 -179.747 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.446 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 18.0 ttp180 -70.91 -55.55 8.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.622 -179.594 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 57.7 tttp -47.67 -23.18 0.63 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.163 0.506 . . . . 0.0 110.948 -179.872 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.429 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 17.8 t -68.4 -60.43 2.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.73 179.903 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.494 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.6 -56.28 24.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.38 -179.156 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.422 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 19.4 t -56.42 -63.17 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.026 -178.245 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 15.0 m120 -57.08 -27.72 61.99 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -178.674 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.469 ' HD1' ' HG2' ' A' ' 78' ' ' GLU . 4.4 t80 -59.83 -31.09 69.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.362 . . . . 0.0 110.359 179.768 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.453 HD22 ' HE2' ' A' ' 89' ' ' MET . 16.6 mt -52.65 -23.77 7.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.107 179.619 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -58.87 -8.75 1.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.215 179.747 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.5 p -93.19 -54.0 3.89 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.553 179.443 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 61.7 m80 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.322 -0.847 . . . . 0.0 110.932 179.843 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mpp? . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.777 0.322 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 66.08 146.82 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.299 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -92.49 -0.26 57.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.01 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -105.38 -6.51 19.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.996 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -142.84 96.47 2.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.784 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -99.31 -35.68 9.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.259 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -88.98 144.15 26.36 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.991 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.8 p -175.71 104.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.393 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.531 ' HG2' ' HE2' ' A' ' 19' ' ' MET . 95.3 mtt180 59.49 19.02 7.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.58 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.441 ' C ' ' H ' ' A' ' 12' ' ' VAL . 12.1 ptp180 -65.97 104.86 1.2 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 20.7 t70 72.41 -10.89 0.87 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.946 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.482 HG13 ' H ' ' A' ' 13' ' ' SER . 3.5 t -84.14 171.78 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.535 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.482 ' H ' HG13 ' A' ' 12' ' ' VAL . 34.5 t -156.79 -24.69 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.681 0.276 . . . . 0.0 111.028 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.659 HG21 ' H ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -88.11 -168.53 2.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.467 179.815 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.659 ' H ' HG21 ' A' ' 14' ' ' THR . . . -94.87 -67.67 0.84 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.493 HD11 ' N ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -78.33 -11.72 59.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.985 -179.027 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.493 ' N ' HD11 ' A' ' 16' ' ' LEU . 46.1 t -45.56 -52.24 10.78 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -174.75 96.43 0.08 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.794 0.331 . . . . 0.0 111.542 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.531 ' HE2' ' HG2' ' A' ' 9' ' ' ARG . 24.7 mmt -133.7 -43.16 0.83 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.774 179.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.12 12.69 38.51 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.337 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -170.14 -59.29 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.825 0.345 . . . . 0.0 111.132 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -66.12 -16.75 64.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.416 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.439 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -99.35 -1.92 37.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.038 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.448 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 2.5 t80 -63.2 -51.57 65.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.244 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -63.4 -55.25 37.08 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.832 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.439 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 44.2 Cg_exo -50.91 -24.9 14.64 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 121.782 1.654 . . . . 0.0 110.349 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.666 HD21 HG13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -76.4 -41.75 46.77 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 114.207 -1.361 . . . . 0.0 109.218 178.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.628 HD21 ' HD2' ' A' ' 53' ' ' ARG . 16.5 tp -70.47 -27.14 63.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.207 178.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -65.93 -41.11 91.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.124 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -61.38 -17.77 55.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.035 -0.53 . . . . 0.0 112.008 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.6 HD13 HD12 ' A' ' 28' ' ' LEU . 80.1 mt -69.37 -11.89 61.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.788 0.328 . . . . 0.0 111.333 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.2 t -109.82 0.82 18.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.825 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -67.92 139.03 56.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.722 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -67.53 -24.03 65.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.315 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.67 139.79 33.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.919 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.1 p-90 -88.1 -26.4 22.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -64.08 -41.55 97.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.004 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.7 mt -80.18 -41.54 21.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.811 0.338 . . . . 0.0 111.122 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 -59.48 -24.52 63.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.592 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.31 -63.61 3.85 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.635 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.61 -37.9 6.05 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.652 0.263 . . . . 0.0 111.258 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.429 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -57.45 -54.21 49.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.323 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.409 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -63.35 -30.81 71.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.703 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -68.47 -34.45 75.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.906 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.0 mt -99.37 -19.36 5.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.343 . . . . 0.0 111.762 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.666 HG13 HD21 ' A' ' 27' ' ' LEU . 3.9 tt -58.38 -34.92 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.24 -17.11 80.27 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.138 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -70.58 -7.15 41.87 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -99.18 -22.17 15.77 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.472 ' HG3' HG21 ' A' ' 80' ' ' ILE . 1.7 mp0 55.96 54.4 8.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 111.391 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -127.47 166.92 17.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.809 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -63.6 -29.11 70.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.628 ' HD2' HD21 ' A' ' 28' ' ' LEU . 1.1 ttp180 -66.33 -11.69 52.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.965 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.468 ' HB1' HG22 ' A' ' 46' ' ' ILE . . . -104.94 -13.59 15.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 86.8 t -68.9 -51.31 45.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.088 -179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.467 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 21.1 tt0 -59.75 -49.63 90.76 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.467 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.2 Cg_exo -41.22 -52.24 3.6 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.371 2.047 . . . . 0.0 112.898 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.517 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . 5.2 mt -60.03 -36.93 78.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.384 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.6 mm -55.02 -59.83 2.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.875 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.463 ' HG3' HD11 ' A' ' 61' ' ' LEU . 3.9 ptpp? -70.76 -40.12 72.87 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.64 ' HG ' HG13 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -57.86 -51.58 69.03 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.465 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.477 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 33.5 mt -55.96 -10.34 0.77 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.716 0.294 . . . . 0.0 111.491 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.02 -20.32 13.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.991 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.13 -40.3 93.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.714 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.437 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 29.5 t70 62.33 27.35 16.34 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.316 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 4.7 m -84.31 17.12 2.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.477 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.79 -96.58 0.68 Allowed Glycine 0 C--O 1.227 -0.337 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.747 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.09 -43.8 64.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.036 0.446 . . . . 0.0 110.61 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.64 HG13 ' HG ' ' A' ' 61' ' ' LEU . 21.8 t -73.35 -39.09 54.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.049 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.477 ' HG2' ' HA ' ' A' ' 62' ' ' LEU . 3.0 tmm_? -77.98 -63.6 1.35 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.668 0.27 . . . . 0.0 111.435 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 48.9 m -51.55 -32.25 27.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.305 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.411 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -63.4 -38.39 96.31 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.437 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.517 ' HB3' ' HA ' ' A' ' 58' ' ' LEU . . . -64.02 -37.37 87.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.704 0.288 . . . . 0.0 111.042 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.16 -57.14 14.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.762 -179.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 75' ' ' ARG . 7.4 ptm85 -58.65 -26.93 64.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.618 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.2 m -58.49 -39.85 81.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.452 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.536 ' HG ' HG13 ' A' ' 85' ' ' VAL . 6.1 mp -59.79 -58.33 9.03 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.744 0.307 . . . . 0.0 110.631 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.446 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 54.1 mt-10 -48.96 -31.17 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.338 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -68.67 -41.93 78.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.141 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.472 HG21 ' HG3' ' A' ' 50' ' ' GLN . 35.3 mt -74.35 -60.87 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 63.14 117.6 0.01 OUTLIER Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.977 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.435 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 145.43 -173.05 25.98 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.753 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -69.45 -30.2 68.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.814 0.34 . . . . 0.0 110.902 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.51 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -52.85 -63.24 1.21 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.851 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.536 HG13 ' HG ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -70.93 -20.61 21.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.9 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.445 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 55.3 ttp180 -56.78 -26.35 57.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.253 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.16 -25.67 27.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.215 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.62 69.41 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.695 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.452 ' HE2' ' HB3' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -69.09 -26.79 65.11 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.249 179.629 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 41.7 mt-10 -69.78 -32.26 70.64 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -76.76 -28.7 55.82 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.622 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.464 HD23 HD11 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -84.54 -30.08 25.39 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.515 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.57 -20.27 66.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.337 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -80.33 -26.86 38.54 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.674 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 51.3 p -118.2 24.4 10.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.827 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.422 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -55.85 116.41 7.19 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.338 -0.846 . . . . 0.0 113.261 -179.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.3 t -140.52 130.24 24.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.828 0.347 . . . . 0.0 110.842 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.86 -135.67 51.79 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.631 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -67.64 -32.01 72.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.618 0.247 . . . . 0.0 111.315 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.411 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.84 -28.75 37.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.687 -179.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.422 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 21.9 ttp180 -75.22 -55.23 5.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.431 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -48.25 -26.95 2.19 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.21 0.529 . . . . 0.0 110.256 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.411 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 37.5 t -59.5 -60.04 3.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.868 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.45 ' CB ' ' HB2' ' A' ' 89' ' ' MET . . . -62.59 -56.55 16.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.433 0.635 . . . . 0.0 111.957 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.586 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 54.8 t -52.38 -54.61 14.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 114.82 -1.082 . . . . 0.0 113.146 -178.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -70.74 -31.48 68.32 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.446 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 21.6 t80 -63.7 -50.96 67.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 4.3 pp -52.42 -15.02 0.55 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.456 -178.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -62.2 -13.71 30.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.088 0.47 . . . . 0.0 110.149 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.02 12.97 6.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.77 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.044 -0.979 . . . . 0.0 111.074 179.88 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtt . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.787 0.327 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -111.61 76.01 0.95 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.239 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 51.34 82.98 0.06 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.089 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -163.12 -63.39 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.83 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -130.26 97.08 4.32 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.792 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -137.91 174.5 10.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.7 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.432 ' HA ' ' HD3' ' A' ' 10' ' ' ARG . 40.7 m95 59.05 25.89 14.44 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.563 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.429 HG11 ' HA ' ' A' ' 22' ' ' GLU . 24.1 t -101.51 145.5 11.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.651 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.492 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 46.3 ttp180 61.04 13.58 4.74 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.789 179.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.432 ' HD3' ' HA ' ' A' ' 7' ' ' TRP . 30.8 mtm180 -66.0 104.36 1.11 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.3 t70 68.31 -3.86 1.21 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.193 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.492 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 41.3 t -77.37 129.69 37.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.897 0.38 . . . . 0.0 111.389 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 89.0 p -164.39 -18.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.461 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.5 p -137.72 -9.52 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.743 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.11 -1.25 56.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.38 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -46.94 -17.09 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.891 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 61.6 m -46.13 -44.57 15.87 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.81 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.423 ' HD3' ' HA ' ' A' ' 18' ' ' ARG . 18.0 tpp180 -173.47 100.34 0.12 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.387 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.473 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 94.9 mmm -132.77 -28.53 1.58 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.601 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 111.22 -133.17 11.35 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.168 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -70.5 -17.58 62.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.937 0.399 . . . . 0.0 110.53 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.429 ' HA ' HG11 ' A' ' 8' ' ' VAL . 27.9 mt-10 -72.42 -29.57 63.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.882 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.557 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -102.83 6.19 39.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.559 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.559 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -60.96 -53.86 52.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.154 0.502 . . . . 0.0 110.124 179.661 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -63.23 -54.92 40.97 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.013 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.557 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 91.9 Cg_exo -43.33 -26.38 0.93 Allowed 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.228 1.952 . . . . 0.0 111.458 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 43.5 mt -74.68 -55.3 6.03 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.937 178.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.56 HD11 HD13 ' A' ' 31' ' ' LEU . 38.1 tp -61.53 -20.96 63.81 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.599 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -80.68 -36.81 31.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.715 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.469 ' HB3' HG21 ' A' ' 38' ' ' ILE . 60.0 m -66.22 -42.42 88.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.859 -179.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.56 HD13 HD11 ' A' ' 28' ' ' LEU . 4.1 pp -63.32 -6.27 4.46 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.2 m -90.32 22.12 3.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.066 0.46 . . . . 0.0 110.525 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -117.5 144.58 44.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.029 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -65.89 -8.76 23.96 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.305 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -77.36 120.69 22.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.947 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -70.68 -35.88 73.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.827 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 53.1 ttp180 -60.11 -54.63 43.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.254 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.469 HG21 ' HB3' ' A' ' 30' ' ' SER . 64.0 mt -65.96 -45.65 90.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.804 0.335 . . . . 0.0 111.0 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.495 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.3 ttm180 -63.2 -20.69 65.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.58 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.65 -66.48 2.27 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.625 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.6 -40.31 19.03 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.688 0.28 . . . . 0.0 111.18 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.99 -52.72 63.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.075 0.464 . . . . 0.0 110.235 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.31 -36.19 82.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.665 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -63.16 -26.28 68.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.471 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.416 HG21 HH12 ' A' ' 18' ' ' ARG . 62.8 mt -99.26 -19.74 5.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.005 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.568 HG21 ' HB3' ' A' ' 54' ' ' ALA . 0.9 OUTLIER -55.39 -39.54 53.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.535 -179.738 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.19 -16.48 73.17 Favored Glycine 0 C--N 1.329 0.193 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.744 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.684 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.7 OUTLIER -64.0 -45.93 86.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.831 0.348 . . . . 0.0 110.379 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.482 ' C ' ' H ' ' A' ' 51' ' ' ASP . 85.2 m-85 -85.54 111.87 20.41 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.659 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.698 ' H ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -74.67 35.02 0.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.377 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.482 ' H ' ' C ' ' A' ' 49' ' ' PHE . 35.6 t70 -100.66 155.31 17.96 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.84 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -63.06 -23.58 67.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.544 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.445 ' NH1' ' HB2' ' A' ' 28' ' ' LEU . 0.9 OUTLIER -57.69 -41.15 81.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.81 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.568 ' HB3' HG21 ' A' ' 46' ' ' ILE . . . -97.37 24.55 6.41 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.7 p -91.41 -37.75 9.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.941 0.4 . . . . 0.0 111.062 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.506 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 24.8 tt0 -60.45 -51.13 82.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.98 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.553 ' HG2' HG12 ' A' ' 46' ' ' ILE . 88.5 Cg_exo -42.81 -52.36 4.67 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.397 2.065 . . . . 0.0 112.761 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' A' ' 73' ' ' ALA . 49.6 mt -56.73 -41.23 77.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.596 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 25.3 mm -53.17 -60.12 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -71.87 -31.04 66.06 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.492 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -66.08 -44.19 85.15 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.549 HD13 HD13 ' A' ' 92' ' ' LEU . 12.0 mt -62.68 -8.96 7.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.967 0.413 . . . . 0.0 110.564 -178.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -126.95 -6.2 6.15 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.27 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -61.17 -33.05 72.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.28 0.562 . . . . 0.0 110.745 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 42.7 m-20 58.75 25.75 13.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.292 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.417 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.1 m -86.04 5.59 32.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.623 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.98 -103.95 2.63 Favored Glycine 0 C--O 1.227 -0.306 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.44 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -50.44 -39.79 48.58 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.182 0.515 . . . . 0.0 110.127 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.492 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.4 t -67.98 -38.29 79.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.539 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.431 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 27.0 ttp180 -76.61 -58.87 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.294 -179.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 62.0 p -50.87 -30.18 13.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.326 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.17 -37.02 94.23 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.616 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.461 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -77.08 -36.92 55.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.61 0.243 . . . . 0.0 111.507 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.405 ' HB3' ' HE1' ' A' ' 99' ' ' PHE . . . -54.98 -49.59 71.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.799 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.42 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 7.3 ptp180 -73.68 -33.8 64.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.283 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.502 ' HA ' HE21 ' A' ' 79' ' ' GLN . 19.8 m -56.5 -39.97 74.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.034 -179.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.1 mt -55.51 -59.58 4.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.747 0.308 . . . . 0.0 110.53 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -49.08 -29.99 5.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.804 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.502 HE21 ' HA ' ' A' ' 76' ' ' SER . 24.9 mt-30 -68.68 -41.71 78.86 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.949 0.404 . . . . 0.0 110.257 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.525 HG22 ' HD2' ' A' ' 84' ' ' ARG . 71.6 mt -69.22 -61.48 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.12 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.463 ' HA2' ' HH ' ' A' ' 107' ' ' TYR . . . 58.94 111.3 0.01 OUTLIER Glycine 0 CA--C 1.518 0.27 0 C-N-CA 121.156 -0.545 . . . . 0.0 113.155 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 165.83 174.26 35.15 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.593 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.93 -22.59 66.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.834 0.349 . . . . 0.0 110.547 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.602 ' HD3' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -75.76 -33.7 60.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.619 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.602 ' N ' ' HD3' ' A' ' 84' ' ' ARG . 3.4 t -68.53 -32.68 56.29 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-O 121.333 0.587 . . . . 0.0 109.756 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 86' ' ' ARG . 9.3 ttt180 -52.48 -26.61 13.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.777 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.29 -41.61 66.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.503 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.04 -43.07 88.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.116 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.588 ' HE3' ' HB2' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -68.98 -36.27 77.67 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.786 0.327 . . . . 0.0 110.387 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.534 ' HG2' ' HE2' ' A' ' 89' ' ' MET . 4.9 mm-40 -63.62 -31.38 72.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.078 0.466 . . . . 0.0 109.976 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -65.59 -39.1 91.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.85 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.583 HD12 ' HB1' ' A' ' 104' ' ' ALA . 29.4 mt -70.94 -40.23 72.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.562 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.444 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -55.79 -22.34 23.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.937 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -92.26 -23.43 19.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.978 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 71.5 p -121.64 39.01 3.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.822 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.404 ' CA ' ' HD3' ' A' ' 101' ' ' ARG . . . -38.42 104.67 0.03 OUTLIER Glycine 0 C--N 1.332 0.353 0 CA-C-N 115.761 -0.654 . . . . 0.0 113.611 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.2 p -144.8 132.18 20.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.838 0.351 . . . . 0.0 110.927 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.69 -143.58 46.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.477 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.405 ' HE1' ' HB3' ' A' ' 74' ' ' ALA . 10.6 p90 -84.16 -24.29 30.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.698 0.285 . . . . 0.0 110.819 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.5 ' HB3' HD11 ' A' ' 92' ' ' LEU . . . -44.9 -36.8 3.51 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.47 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.444 ' NE ' ' HA ' ' A' ' 93' ' ' ALA . 14.1 tpt180 -64.3 -61.88 1.96 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -54.46 -33.37 59.51 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.201 0.524 . . . . 0.0 110.261 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 43.3 t -65.19 -44.7 95.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.075 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.583 ' HB1' HD12 ' A' ' 92' ' ' LEU . . . -64.99 -59.02 4.63 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 61.1 t -55.15 -62.68 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.612 -178.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -55.46 -38.21 68.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.723 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.463 ' HH ' ' HA2' ' A' ' 81' ' ' GLY . 9.5 t80 -58.82 -44.66 90.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.906 0.384 . . . . 0.0 111.644 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.588 ' HB2' ' HE3' ' A' ' 89' ' ' MET . 0.2 OUTLIER -51.1 -17.74 0.7 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.026 -178.522 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -61.11 -8.94 3.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 111.004 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 56.1 p -122.29 -41.8 2.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.179 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 71.6 m80 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.809 -179.947 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.1 mtm . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.745 0.307 . . . . 0.0 110.962 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.96 26.69 10.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.249 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -92.9 -71.14 0.67 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.864 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -100.27 -44.64 5.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.922 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -95.15 102.06 13.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.053 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -110.67 -62.72 1.49 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.3 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -36.79 13.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.265 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.425 HG13 ' H ' ' A' ' 9' ' ' ARG . 1.7 t 49.6 -141.2 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.321 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.492 HH11 ' HG3' ' A' ' 26' ' ' PRO . 57.3 ttp180 -81.88 -7.21 59.59 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.647 0.261 . . . . 0.0 111.305 -179.164 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 62.9 ttt180 -58.17 129.87 43.98 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.425 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 30.9 m-20 66.31 14.7 9.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.89 0.376 . . . . 0.0 110.606 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 40.3 t -133.09 145.64 33.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.831 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.9 p -160.87 7.49 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.378 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.9 m -131.74 32.06 4.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.939 0.4 . . . . 0.0 111.075 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.524 ' HB1' ' HB2' ' A' ' 23' ' ' ALA . . . -88.9 -2.45 58.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.242 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.557 ' HG ' ' HB3' ' A' ' 23' ' ' ALA . 5.4 mp -69.4 -18.76 63.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.505 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.2 t -47.14 -51.18 18.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.824 0.345 . . . . 0.0 111.044 -179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -176.39 -7.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.362 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.455 ' HB2' ' HB3' ' A' ' 15' ' ' ALA . 4.3 mtp -57.95 -38.28 75.67 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.569 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 58.31 -170.6 4.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.795 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 61.31 -79.55 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.714 0.292 . . . . 0.0 111.18 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -55.54 -41.63 73.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.698 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.557 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . . . -105.66 18.68 21.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.703 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.474 ' HZ ' ' HB3' ' A' ' 54' ' ' ALA . 2.5 t80 -60.63 -46.54 89.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.508 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -54.08 47.0 Favored Pre-proline 0 N--CA 1.466 0.329 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.492 ' HG3' HH11 ' A' ' 9' ' ' ARG . 53.0 Cg_exo -46.32 -23.88 2.28 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.902 1.735 . . . . 0.0 111.011 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.549 HD21 HG13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -83.96 -46.83 11.65 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 114.322 -1.308 . . . . 0.0 110.128 179.667 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 31' ' ' LEU . 15.1 tp -69.13 -16.93 63.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.363 179.147 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -75.61 -36.57 60.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.771 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.4 m -66.34 -20.28 66.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.825 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 28' ' ' LEU . 91.2 mt -65.86 -9.52 29.82 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.574 0.226 . . . . 0.0 111.542 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.5 m -101.5 11.69 38.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.079 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -71.47 148.04 47.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.018 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.43 -18.28 65.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.965 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -86.76 162.48 17.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.791 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -102.86 -39.62 6.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.798 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -58.74 -37.5 76.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.894 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.2 mm -61.59 -41.57 90.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.717 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 76.4 mtt180 -62.45 -24.5 67.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.398 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.62 -64.36 3.63 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.858 -0.686 . . . . 0.0 112.197 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.74 -33.8 36.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.781 0.324 . . . . 0.0 110.948 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.34 -55.46 15.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.583 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.62 -26.01 68.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.742 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.415 ' NE1' ' HA2' ' A' ' 72' ' ' GLY . 5.3 m95 -70.63 -32.82 70.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.135 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.528 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 41.4 mt -99.46 -22.88 4.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.945 0.403 . . . . 0.0 111.41 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.549 HG13 HD21 ' A' ' 27' ' ' LEU . 4.4 tt -61.02 -37.56 77.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.19 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -78.08 -14.8 81.9 Favored Glycine 0 C--N 1.33 0.216 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.221 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.528 ' ND2' ' HA ' ' A' ' 45' ' ' ILE . 51.0 m-20 -70.74 -14.76 62.56 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -93.76 -10.31 34.67 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.421 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.7 OUTLIER 50.51 61.54 3.16 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.815 0.341 . . . . 0.0 111.412 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -127.93 161.68 28.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.164 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.69 -36.15 82.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.723 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -65.71 -9.06 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.046 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.474 ' HB3' ' HZ ' ' A' ' 24' ' ' PHE . . . -102.99 -13.67 16.79 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.866 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 41.7 t -72.15 -38.87 64.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.439 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.484 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 26.4 tt0 -57.07 -51.51 81.15 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.624 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.484 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 89.6 Cg_exo -41.97 -51.64 4.5 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.261 1.974 . . . . 0.0 112.156 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.445 HD23 ' HG ' ' A' ' 77' ' ' LEU . 8.4 mp -52.69 -37.5 59.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.961 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.2 mm -56.58 -61.44 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -72.4 -10.41 59.76 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.472 HD12 ' O ' ' A' ' 57' ' ' PRO . 1.8 mp -89.37 -49.39 6.73 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.413 HD22 HD22 ' A' ' 92' ' ' LEU . 11.4 mt -56.45 -15.52 4.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.851 0.358 . . . . 0.0 111.181 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -113.71 -11.82 12.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.454 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.7 OUTLIER -61.08 -46.09 92.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.056 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.584 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 14.4 t70 63.08 24.45 14.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.152 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.44 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.6 m -86.2 7.58 24.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.012 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.89 -108.47 3.52 Favored Glycine 0 C--O 1.229 -0.204 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.425 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -48.81 -30.9 6.25 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.257 0.551 . . . . 0.0 109.634 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.44 ' HB ' ' HB2' ' A' ' 66' ' ' SER . 58.8 t -72.08 -50.81 34.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.783 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.584 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 38.3 ttp180 -68.2 -62.45 1.39 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.108 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.5 m -51.04 -27.67 8.52 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.957 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.415 ' HA2' ' NE1' ' A' ' 44' ' ' TRP . . . -57.84 -56.2 26.44 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.73 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.439 ' CB ' ' HA ' ' A' ' 58' ' ' LEU . . . -56.2 -46.15 79.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.854 0.359 . . . . 0.0 110.907 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.12 -27.18 63.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.775 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.417 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 27.3 ttt-85 -83.8 -34.6 24.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.814 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.415 ' HA ' HE21 ' A' ' 79' ' ' GLN . 47.5 m -61.98 -39.47 92.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.621 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.445 ' HG ' HD23 ' A' ' 58' ' ' LEU . 1.1 mt -59.25 -59.24 5.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.717 0.294 . . . . 0.0 111.411 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -48.93 -38.86 24.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.706 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 41.4 mt-30 -70.81 -47.79 57.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.628 0.251 . . . . 0.0 111.37 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.531 HG23 ' HB ' ' A' ' 85' ' ' VAL . 90.0 mt -61.43 -60.63 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.36 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 53.88 70.55 0.9 Allowed Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.579 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -152.45 164.71 30.7 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.552 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -65.17 -27.64 68.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.848 0.356 . . . . 0.0 110.859 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.489 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -69.28 -50.99 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.875 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.531 ' HB ' HG23 ' A' ' 80' ' ' ILE . 9.9 p -70.77 -23.87 24.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.272 0.558 . . . . 0.0 110.331 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -53.46 -29.99 38.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.806 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.403 ' O ' ' HG2' ' A' ' 91' ' ' LYS . . . -65.87 -31.41 72.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.267 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.07 -51.38 69.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.968 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.432 ' SD ' ' N ' ' A' ' 90' ' ' GLU . 3.4 ppp? -69.72 -24.87 63.63 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.822 0.344 . . . . 0.0 110.387 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.432 ' N ' ' SD ' ' A' ' 89' ' ' MET . 28.2 mt-10 -68.17 -40.16 82.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.967 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 46.4 mmtm -78.78 -21.71 47.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.119 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 100' ' ' ALA . 0.3 OUTLIER -86.69 -30.33 21.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.786 0.327 . . . . 0.0 110.207 179.779 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.19 -26.81 67.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.975 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -80.11 -25.64 39.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.083 0.468 . . . . 0.0 110.288 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.2 p -117.4 24.42 11.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.349 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.493 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -58.24 121.68 27.04 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.153 -179.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 92.3 m -139.69 130.42 25.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.57 -0.315 . . . . 0.0 110.76 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.32 -133.8 52.6 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.759 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -66.41 -33.78 76.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.787 0.327 . . . . 0.0 111.146 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.454 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -51.28 -38.69 54.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.014 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.493 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 39.9 ttt180 -70.44 -60.02 2.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.811 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -46.57 -25.2 0.65 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.155 0.503 . . . . 0.0 110.749 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.413 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 37.1 t -67.7 -60.52 2.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.259 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.425 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -50.36 -59.65 3.77 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.5 t -58.4 -64.27 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -55.56 -38.34 69.21 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -58.84 -48.19 82.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.867 0.365 . . . . 0.0 111.445 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.425 ' HB3' ' HE2' ' A' ' 89' ' ' MET . 0.1 OUTLIER -53.61 -21.48 6.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.807 -178.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -54.98 -21.3 11.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.864 0.364 . . . . 0.0 110.992 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.9 p -95.25 -49.11 5.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.146 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 73.4 m80 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.865 -179.98 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 mtt . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 120.634 0.254 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.81 14.57 1.37 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.407 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -145.37 133.01 20.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.649 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 62.45 -86.12 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.127 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -70.86 122.01 19.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.837 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -167.9 -18.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.933 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 14.8 p-90 -161.48 21.68 0.12 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.266 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 40.3 t -76.57 77.56 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.138 0.494 . . . . 0.0 111.287 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.569 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 5.3 mpt_? 51.96 20.04 1.14 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.806 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -70.21 104.68 2.7 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.439 ' H ' ' HE3' ' A' ' 19' ' ' MET . 12.9 t70 69.08 13.25 8.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.805 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.569 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 12.9 p -55.62 -26.91 20.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.042 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.6 t -168.8 -75.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.565 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.433 ' O ' ' HG3' ' A' ' 19' ' ' MET . 22.2 p -116.98 170.98 8.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.504 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.466 ' HA ' ' HE2' ' A' ' 19' ' ' MET . . . -96.15 -69.5 0.75 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -86.26 -13.86 45.48 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.405 ' HB3' ' CB ' ' A' ' 14' ' ' THR . 31.8 t -83.33 -51.31 7.53 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -144.88 93.28 2.38 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.532 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 7.9 mtt -134.41 -4.65 2.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.906 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.69 -109.09 2.7 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.595 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -84.18 -28.34 27.43 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.943 0.402 . . . . 0.0 110.689 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -79.17 4.97 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.317 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.532 ' HB2' ' HB2' ' A' ' 19' ' ' MET . . . -99.88 -22.53 15.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.938 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.561 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -57.21 -50.83 71.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.702 -179.422 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.478 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.38 -55.71 33.25 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.634 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 87.6 Cg_exo -45.56 -27.81 3.8 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 122.093 1.862 . . . . 0.0 111.438 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.561 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 47.5 mt -71.17 -50.16 36.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.845 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.537 HD13 HD11 ' A' ' 31' ' ' LEU . 10.4 tp -73.08 -18.41 61.31 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.448 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -81.53 -39.52 24.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.389 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.5 t -66.39 -10.83 47.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.729 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.537 HD11 HD13 ' A' ' 28' ' ' LEU . 58.4 mt -63.51 -21.08 66.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.711 0.291 . . . . 0.0 111.116 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.9 p -104.52 8.77 35.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.844 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -64.65 150.37 47.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.149 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -67.86 -44.43 77.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.829 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -77.73 133.52 38.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.003 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.1 m0 -79.71 -22.44 43.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.675 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -61.99 -48.31 80.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.47 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.6 mt -75.46 -37.61 38.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.666 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.52 ' HG2' ' HA ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -61.64 -32.65 72.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.225 179.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.44 -57.38 7.47 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.307 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.21 -29.18 1.48 Allowed 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 120.798 0.332 . . . . 0.0 111.287 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.67 -54.85 42.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.366 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.79 -29.29 70.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.673 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -65.29 -34.41 78.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.242 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.427 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 29.1 mt -101.05 -20.82 5.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.855 0.359 . . . . 0.0 111.599 -179.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.445 HD11 ' HG2' ' A' ' 57' ' ' PRO . 1.3 tt -60.42 -36.89 72.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.84 -8.23 72.32 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.244 -0.979 . . . . 0.0 112.703 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.631 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.7 OUTLIER -70.78 -22.75 62.34 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.568 0.21 . . . . 0.0 111.568 -179.503 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -88.24 -32.86 18.32 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.722 0.268 . . . . 0.0 111.722 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.583 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 36.3 mt-30 66.22 19.04 11.06 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.593 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -86.11 169.41 13.15 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.759 0.314 . . . . 0.0 110.804 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.67 -36.82 85.52 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.613 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 32.0 ttm180 -68.05 -9.88 49.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.815 0.34 . . . . 0.0 111.066 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -104.15 4.54 34.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.165 0.507 . . . . 0.0 110.41 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.3 t -91.12 -33.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.7 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.54 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.4 tm-20 -60.21 -50.24 86.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.766 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.54 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 82.4 Cg_exo -46.86 -49.4 12.46 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.304 2.003 . . . . 0.0 112.471 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.516 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . 6.6 mt -58.84 -28.25 65.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.716 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.8 mm -63.38 -61.3 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 64' ' ' ASP . 21.8 ttpt -72.02 -39.17 69.36 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.48 ' HG ' HG11 ' A' ' 69' ' ' VAL . 2.4 mp -55.54 -51.32 67.46 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -178.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.548 HD12 HD22 ' A' ' 77' ' ' LEU . 49.9 mt -62.19 -10.19 9.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.109 0.48 . . . . 0.0 110.358 -179.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -113.91 -15.06 12.41 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.025 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' A' ' 60' ' ' LYS . 10.3 t0 -61.09 -47.72 84.98 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.383 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.515 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 5.7 m-20 62.55 28.15 16.57 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.458 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.441 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 48.1 t -84.8 -16.99 39.58 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 111.089 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 113.98 -104.82 1.5 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.026 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.16 -28.26 10.63 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.46 0.648 . . . . 0.0 109.301 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.48 HG11 ' HG ' ' A' ' 61' ' ' LEU . 17.8 t -73.67 -54.99 13.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.812 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.515 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 32.7 ttp180 -66.94 -61.52 1.9 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.047 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.0 t -52.06 -31.56 30.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.933 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.34 -35.33 90.8 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.321 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.516 ' HB3' ' HA ' ' A' ' 58' ' ' LEU . . . -84.68 -23.43 29.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.741 0.305 . . . . 0.0 111.045 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.51 -52.87 63.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.153 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.508 HH21 ' HB2' ' A' ' 76' ' ' SER . 0.0 OUTLIER -79.44 -17.28 54.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.012 179.847 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.514 ' HG ' HD23 ' A' ' 58' ' ' LEU . 48.3 t -63.48 -45.94 88.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.886 0.374 . . . . 0.0 110.497 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.609 HD11 ' HE2' ' A' ' 89' ' ' MET . 0.4 OUTLIER -56.84 -57.44 12.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.227 179.56 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -55.21 -34.45 63.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.53 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.508 ' NE2' HH22 ' A' ' 75' ' ' ARG . 10.7 tt0 -68.73 -23.78 64.39 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.964 0.412 . . . . 0.0 110.16 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.583 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 57.2 mt -81.95 -61.02 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.447 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 56.6 92.82 0.01 OUTLIER Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.718 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 173.26 172.13 38.51 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.595 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -63.69 -26.45 68.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.834 0.35 . . . . 0.0 110.948 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.485 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -61.78 -57.46 11.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.826 -179.684 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.472 ' H ' ' HG2' ' A' ' 84' ' ' ARG . 9.9 p -70.68 -23.7 24.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.648 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 3.2 tmt_? -51.35 -33.46 29.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.375 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.18 -32.46 56.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.642 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.14 -36.5 73.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.748 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.609 ' HE2' HD11 ' A' ' 77' ' ' LEU . 1.6 mmm -69.8 -53.47 18.1 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.317 -0.401 . . . . 0.0 109.93 179.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -54.22 -29.13 45.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.298 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -76.87 -32.08 57.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.55 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.586 HD22 ' HB2' ' A' ' 104' ' ' ALA . 1.3 tp -86.74 -29.44 22.37 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.936 0.398 . . . . 0.0 110.427 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.25 -31.77 65.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.887 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -80.16 -24.71 40.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.319 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.7 p -118.35 33.09 5.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.555 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.427 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -48.23 124.79 11.68 Favored Glycine 0 N--CA 1.449 -0.44 0 CA-C-N 114.951 -1.022 . . . . 0.0 114.085 -178.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 20.2 m -143.33 130.31 20.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.493 -0.354 . . . . 0.0 110.162 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 65.74 -142.41 43.65 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.347 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -81.6 -22.23 37.83 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.709 0.29 . . . . 0.0 110.933 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.498 ' HB3' ' HB3' ' A' ' 62' ' ' LEU . . . -49.92 -41.08 45.28 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.909 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.427 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 61.6 ttt180 -56.14 -60.88 2.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.739 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -54.69 -25.92 30.25 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.562 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.6 t -72.4 -50.83 32.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.742 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.586 ' HB2' HD22 ' A' ' 92' ' ' LEU . . . -53.26 -55.53 23.76 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.8 t -60.81 -61.78 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.724 -178.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.402 ' HA ' ' OE2' ' A' ' 109' ' ' GLU . 13.1 m120 -56.35 -36.33 68.65 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -61.91 -30.74 71.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.963 0.411 . . . . 0.0 111.232 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.5 mt -56.27 -15.95 4.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.977 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.402 ' OE2' ' HA ' ' A' ' 106' ' ' ASN . 0.5 OUTLIER -75.23 1.21 14.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.434 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 61.4 p -111.81 -61.6 1.68 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.742 0.306 . . . . 0.0 111.023 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.814 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 120.781 0.325 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.43 -87.61 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.711 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -61.54 -36.22 79.96 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.873 0.368 . . . . 0.0 110.921 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.03 -168.62 1.32 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.791 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -55.91 109.34 0.56 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.759 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -139.06 -30.26 0.74 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.523 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 70.1 m95 -98.57 114.0 26.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.905 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.538 HG11 ' HG2' ' A' ' 9' ' ' ARG . 7.7 p -164.78 -40.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.802 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.538 ' HG2' HG11 ' A' ' 8' ' ' VAL . 29.8 ptt180 -173.85 -21.48 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.622 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 91.0 mtt180 -57.71 115.02 2.55 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.415 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 12.3 t70 77.24 -49.18 0.53 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.718 0.636 . . . . 0.0 110.594 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.2 t -67.68 92.86 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.673 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.7 t -81.17 -16.93 51.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.217 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.61 ' HB ' ' HB2' ' A' ' 17' ' ' SER . 68.6 p -57.94 135.64 56.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.809 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.423 ' HB2' HD11 ' A' ' 16' ' ' LEU . . . -95.58 -67.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.046 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.442 HD11 ' N ' ' A' ' 16' ' ' LEU . 4.7 mp -82.61 -16.16 49.44 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -178.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.61 ' HB2' ' HB ' ' A' ' 14' ' ' THR . 14.8 m -70.74 -50.45 36.01 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.301 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.43 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 0.8 OUTLIER -172.05 122.48 0.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.833 0.349 . . . . 0.0 111.412 -179.491 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.509 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 63.8 mmm -133.34 -26.26 1.67 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.517 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.447 ' C ' ' H ' ' A' ' 22' ' ' GLU . . . 83.5 86.6 0.83 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.519 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 65.99 -4.99 0.58 Allowed 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 122.343 0.257 . . . . 0.0 111.536 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.509 ' HB2' ' HB3' ' A' ' 19' ' ' MET . 13.0 mm-40 -103.61 -14.63 16.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.016 0.436 . . . . 0.0 110.108 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.03 -1.44 25.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.416 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.469 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 4.6 t80 -57.85 -60.19 4.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.406 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.519 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -63.51 -53.32 52.84 Favored Pre-proline 0 N--CA 1.466 0.328 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.863 -178.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.537 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 9.7 Cg_endo -51.56 -25.41 19.47 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 121.777 1.652 . . . . 0.0 110.513 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.541 HD23 HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -75.77 -40.59 55.0 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.128 178.064 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.597 HD23 ' HD3' ' A' ' 53' ' ' ARG . 6.1 tp -73.84 -20.46 60.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.137 177.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 25' ' ' GLU . 3.2 tm-20 -77.69 -40.97 39.66 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.599 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.7 m -61.76 -19.55 62.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.263 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.495 HD12 HD11 ' A' ' 28' ' ' LEU . 79.1 mt -66.85 -9.35 36.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.729 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.0 t -109.6 18.9 19.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.872 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -85.36 135.12 34.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.939 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -58.56 -25.51 62.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.786 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -83.67 153.69 24.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.729 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -104.89 -25.88 12.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -63.01 -36.59 84.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.867 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.5 mt -81.19 -36.94 15.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.8 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -63.91 -31.84 73.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -56.6 -57.08 21.29 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.354 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.34 -38.82 59.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.691 0.281 . . . . 0.0 110.977 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.43 -50.62 71.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.383 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.429 ' HB2' HD23 ' A' ' 61' ' ' LEU . . . -65.24 -35.29 80.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.745 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.4 m95 -66.1 -32.13 73.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.926 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.453 ' HA ' HD21 ' A' ' 48' ' ' ASN . 38.7 mm -99.41 -23.14 4.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.541 HD11 HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -54.52 -37.82 39.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -178.536 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -67.68 -19.51 71.25 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.867 -0.682 . . . . 0.0 113.769 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.453 HD21 ' HA ' ' A' ' 45' ' ' ILE . 42.1 m-80 -70.69 -0.89 9.72 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -101.64 -26.26 13.58 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.495 ' HG2' HG23 ' A' ' 80' ' ' ILE . 19.6 mt-30 62.11 18.3 9.9 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -93.43 167.84 11.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.614 0.245 . . . . 0.0 110.692 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -62.32 -31.8 72.47 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.812 0.339 . . . . 0.0 110.684 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.597 ' HD3' HD23 ' A' ' 28' ' ' LEU . 34.4 ttm180 -69.2 -9.52 53.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.011 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.421 ' CB ' HD12 ' A' ' 46' ' ' ILE . . . -100.24 -7.54 24.54 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.207 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.4 t -91.14 -39.18 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.577 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.531 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 21.5 tt0 -60.51 -50.85 83.7 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 89.1 Cg_exo -47.8 -45.73 23.43 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.11 1.874 . . . . 0.0 112.029 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.537 HD21 ' HA ' ' A' ' 73' ' ' ALA . 4.6 mt -57.95 -31.47 66.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.639 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.405 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 50.9 mm -57.41 -61.54 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -11.75 60.79 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.605 ' HG ' HG13 ' A' ' 69' ' ' VAL . 1.3 mp -84.85 -49.63 8.24 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.513 HD23 HD22 ' A' ' 92' ' ' LEU . 8.8 mt -59.4 -10.05 2.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.17 0.51 . . . . 0.0 110.289 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 59' ' ' ILE . 8.2 pt-20 -115.42 -17.22 11.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.18 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -61.07 -32.81 72.45 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.151 0.501 . . . . 0.0 110.943 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.613 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 1.5 m-20 50.4 30.08 4.33 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.722 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.467 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 47.5 t -85.94 2.41 46.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.776 0.322 . . . . 0.0 111.094 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.28 -89.13 1.6 Allowed Glycine 0 C--O 1.228 -0.244 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.694 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -58.76 -38.55 78.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.932 0.396 . . . . 0.0 110.224 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.605 HG13 ' HG ' ' A' ' 61' ' ' LEU . 14.3 t -73.77 -49.23 36.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.233 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.613 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 45.9 ttp180 -62.48 -58.3 8.12 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.927 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 33.4 t -51.96 -26.76 11.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.771 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -60.12 -39.77 96.27 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.542 -0.837 . . . . 0.0 111.544 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.537 ' HA ' HD21 ' A' ' 58' ' ' LEU . . . -71.26 -49.96 37.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.847 0.356 . . . . 0.0 110.42 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.97 -25.69 58.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.274 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -84.16 -32.46 24.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.502 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.488 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 66.9 m -67.08 -44.78 79.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.008 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.577 ' HA ' HG21 ' A' ' 85' ' ' VAL . 2.5 mp -55.67 -59.64 4.56 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.513 -179.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -49.28 -36.14 19.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.714 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.488 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 19.9 mt-30 -66.07 -57.87 6.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.812 0.339 . . . . 0.0 111.186 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.495 HG23 ' HG2' ' A' ' 50' ' ' GLN . 92.0 mt -53.92 -60.34 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.412 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 59.73 88.45 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.41 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 175.12 172.46 40.06 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.48 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -65.91 -22.48 66.51 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.747 0.308 . . . . 0.0 111.267 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.486 ' HG2' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -63.37 -62.84 1.41 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.472 -179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.577 HG21 ' HA ' ' A' ' 77' ' ' LEU . 3.4 p -70.85 -21.18 22.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.728 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -50.66 -46.38 58.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.376 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.32 -24.0 26.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.061 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.46 -42.55 68.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.402 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.577 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -71.88 -30.82 65.8 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.446 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.429 ' HG2' ' HE3' ' A' ' 89' ' ' MET . 47.1 mt-10 -66.7 -39.27 88.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.649 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -77.57 -23.0 50.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.131 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.513 HD22 HD23 ' A' ' 62' ' ' LEU . 1.2 tp -85.99 -26.98 25.14 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.34 -24.09 66.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.412 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -80.29 -26.49 38.88 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.411 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 64.3 p -117.01 20.23 13.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.556 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.505 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -53.7 121.74 19.35 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 115.095 -0.957 . . . . 0.0 113.27 -179.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.8 m -142.67 130.13 21.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.79 0.328 . . . . 0.0 110.835 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 57.84 -129.34 49.39 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.845 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.423 ' O ' HG23 ' A' ' 103' ' ' VAL . 57.2 t80 -70.25 -35.04 73.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.727 0.299 . . . . 0.0 111.204 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.422 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -52.0 -35.96 48.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.049 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.505 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 45.4 ttt180 -72.21 -57.27 4.38 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -48.28 -21.99 0.6 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.122 0.487 . . . . 0.0 110.762 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 99' ' ' PHE . 32.4 t -68.35 -60.4 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.645 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.577 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -54.75 -54.75 37.9 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.282 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.489 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 57.4 t -59.02 -61.38 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.586 -178.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -56.1 -37.92 70.05 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -58.73 -29.19 66.51 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.489 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -51.51 -28.96 14.97 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -75.22 6.78 3.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.662 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.5 m -100.22 -61.13 1.41 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.685 0.279 . . . . 0.0 111.465 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.94 -179.749 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 ttp . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.774 0.321 . . . . 0.0 110.827 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.79 -168.52 1.61 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.115 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.0 t70 63.06 -83.54 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.406 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.12 85.35 0.36 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.216 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.411 ' OD1' ' HB ' ' A' ' 8' ' ' VAL . 50.3 t-20 179.35 -63.32 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.291 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.0 tptp 65.23 -80.05 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.685 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -121.55 100.01 6.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.153 0.501 . . . . 0.0 112.324 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.563 HG22 ' HG3' ' A' ' 9' ' ' ARG . 5.5 p -101.65 138.19 26.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.85 178.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.573 ' HA ' ' HB2' ' A' ' 17' ' ' SER . 72.8 mtp180 67.32 -75.41 0.06 Allowed 'General case' 0 N--CA 1.464 0.245 0 O-C-N 123.257 0.348 . . . . 0.0 110.97 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.431 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 36.9 ptt180 -48.2 161.4 0.11 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.77 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.431 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 20.5 t70 73.33 -5.65 1.92 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.521 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.444 HG12 ' H ' ' A' ' 14' ' ' THR . 99.3 t -138.04 -62.88 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.189 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.4 p 63.66 26.97 14.74 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.475 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.444 ' H ' HG12 ' A' ' 12' ' ' VAL . 30.9 p -113.01 -172.14 2.0 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.585 0.231 . . . . 0.0 110.921 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.1 -43.33 95.63 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.841 0.353 . . . . 0.0 111.293 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.597 HD13 HD21 ' A' ' 27' ' ' LEU . 13.9 mt -58.23 -43.77 87.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.549 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.573 ' HB2' ' HA ' ' A' ' 9' ' ' ARG . 83.0 p -87.0 -8.2 57.41 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.73 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 14' ' ' THR . 21.2 tpp180 -65.98 -55.74 15.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.486 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.512 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 10.3 mtp -82.38 -6.69 59.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.915 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.71 -135.8 22.29 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.906 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -67.97 -0.37 4.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.799 0.333 . . . . 0.0 111.022 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -88.95 -27.13 21.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.72 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HB3' ' O ' ' A' ' 16' ' ' LEU . . . -87.95 5.75 39.14 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.272 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.535 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.0 t80 -61.76 -40.9 96.76 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.306 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.31 -55.56 34.97 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.469 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.503 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 65.9 Cg_exo -38.16 -29.57 0.14 Allowed 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 122.655 2.237 . . . . 0.0 112.124 178.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.597 HD21 HD13 ' A' ' 16' ' ' LEU . 28.4 mt -66.46 -58.67 4.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.39 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.586 HD13 HD11 ' A' ' 31' ' ' LEU . 24.3 tp -66.74 -20.18 65.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.201 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -79.35 -34.64 41.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.849 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.493 ' HB3' HG22 ' A' ' 38' ' ' ILE . 75.6 m -65.77 -24.68 66.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.46 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.586 HD11 HD13 ' A' ' 28' ' ' LEU . 82.5 mt -61.63 -12.06 14.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.791 0.329 . . . . 0.0 110.988 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.5 m -91.13 20.32 5.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.135 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -103.91 138.94 39.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.901 0.381 . . . . 0.0 111.258 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -67.75 -15.53 63.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.679 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -76.12 152.18 36.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.107 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 15.5 m0 -95.7 -36.14 11.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.095 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -58.85 -38.2 78.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.187 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.493 HG22 ' HB3' ' A' ' 30' ' ' SER . 41.0 mt -75.11 -34.52 31.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.721 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.4 ' HD2' HD12 ' A' ' 61' ' ' LEU . 7.1 mmt180 -60.7 -55.85 28.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.276 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.3 -57.12 21.52 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.954 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.73 -36.24 4.87 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.766 0.317 . . . . 0.0 111.509 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.464 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.77 -53.33 57.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.044 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.32 -25.77 63.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.606 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.403 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 7.1 m95 -60.36 -42.54 95.98 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.681 0.622 . . . . 0.0 112.681 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.6 mm -99.35 -23.59 4.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.6 HD11 ' HG2' ' A' ' 57' ' ' PRO . 5.6 tt -59.87 -33.95 54.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -178.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.58 -27.13 69.21 Favored Glycine 0 CA--C 1.518 0.22 0 C-N-CA 120.707 -0.759 . . . . 0.0 113.254 -179.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -70.73 0.72 6.47 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -94.67 -27.41 15.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.627 ' HG3' ' HA ' ' A' ' 80' ' ' ILE . 14.9 mp0 62.35 26.04 15.55 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.234 0.54 . . . . 0.0 110.778 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -102.57 166.31 10.59 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.121 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -65.56 -34.83 79.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.16 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.498 ' HG3' HD23 ' A' ' 28' ' ' LEU . 34.2 ttm180 -67.34 -10.02 46.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.56 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -104.82 0.36 28.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.633 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.4 t -90.69 -50.16 13.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.541 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.536 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.3 tm-20 -58.62 -49.38 93.77 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.958 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.6 ' HG2' HD11 ' A' ' 46' ' ' ILE . 72.8 Cg_exo -49.83 -27.44 15.75 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.32 2.013 . . . . 0.0 112.762 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.529 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . 23.4 mt -74.23 -54.1 8.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.097 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.447 ' HA ' HD12 ' A' ' 62' ' ' LEU . 44.7 mm -49.66 -48.21 20.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.875 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -70.02 -30.16 67.4 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 -179.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.57 ' HG ' HG13 ' A' ' 69' ' ' VAL . 4.1 tp -89.82 -17.99 27.09 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.54 HD11 HD22 ' A' ' 92' ' ' LEU . 14.1 mt -70.43 -14.38 62.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.016 0.436 . . . . 0.0 110.828 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -115.12 6.75 15.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.03 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -61.11 -32.21 71.9 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.244 0.545 . . . . 0.0 110.841 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.507 ' HB2' HH21 ' A' ' 70' ' ' ARG . 18.8 t70 55.32 23.72 5.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.066 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.504 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 31.0 t -86.29 -26.01 25.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.84 0.353 . . . . 0.0 110.693 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 125.34 -109.36 1.18 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.485 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.403 ' HD1' ' NE1' ' A' ' 44' ' ' TRP . 0.1 OUTLIER -56.93 -24.33 51.72 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.253 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.57 HG13 ' HG ' ' A' ' 61' ' ' LEU . 39.9 t -68.59 -36.53 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.798 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.507 HH21 ' HB2' ' A' ' 65' ' ' ASP . 19.5 ttm180 -78.45 -51.17 10.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.726 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.1 m -58.02 -37.7 74.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.078 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.09 -51.34 50.87 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.224 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.529 ' HB3' ' HA ' ' A' ' 58' ' ' LEU . . . -67.34 -34.02 76.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.934 0.397 . . . . 0.0 110.703 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.529 ' HA ' HD23 ' A' ' 62' ' ' LEU . . . -55.48 -61.58 2.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.952 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -57.17 -27.71 62.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.019 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.421 ' O ' HG13 ' A' ' 80' ' ' ILE . 49.0 m -61.63 -29.92 70.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.76 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.491 HD12 HD13 ' A' ' 62' ' ' LEU . 8.3 mp -55.57 -61.34 2.41 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.711 0.291 . . . . 0.0 111.517 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.423 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 6.1 pt-20 -61.31 -24.99 66.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.997 0.427 . . . . 0.0 110.558 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -70.67 -23.95 62.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.234 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.627 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 91.6 mt -81.83 -60.38 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.543 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . 174.93 -130.94 1.85 Allowed Glycine 0 C--N 1.334 0.433 0 C-N-CA 119.962 -1.113 . . . . 0.0 113.805 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.461 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . -140.89 -72.89 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.768 -0.729 . . . . 0.0 113.623 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -60.9 -25.5 66.78 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.545 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -86.2 -50.71 6.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.675 0.274 . . . . 0.0 111.038 -179.361 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.545 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -70.84 -20.86 22.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.474 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -49.57 -30.4 8.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.522 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.42 -32.23 54.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.144 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.14 -51.48 37.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.941 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.56 ' HE2' ' HB3' ' A' ' 104' ' ' ALA . 4.1 ppp? -64.19 -25.68 68.18 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.548 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -70.21 -37.83 75.14 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -69.7 -28.91 66.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.476 179.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.54 HD22 HD11 ' A' ' 62' ' ' LEU . 1.4 tp -87.57 -27.53 22.51 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.961 0.41 . . . . 0.0 110.123 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.17 -30.97 71.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.253 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.454 ' HG3' HG22 ' A' ' 95' ' ' THR . 12.1 pt-20 -80.22 -22.99 41.21 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 121.088 0.47 . . . . 0.0 109.758 179.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.454 HG22 ' HG3' ' A' ' 94' ' ' GLU . 52.3 p -108.9 13.16 24.98 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.506 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.79 113.94 4.41 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 114.957 -1.019 . . . . 0.0 113.028 -179.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 39.4 m -140.31 130.09 24.48 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.474 -0.363 . . . . 0.0 110.868 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.69 -126.65 42.56 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.638 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -73.52 -34.23 65.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.674 0.273 . . . . 0.0 111.263 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.436 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.63 -33.27 54.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.983 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.506 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 29.7 ttt180 -72.39 -56.07 6.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.365 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -48.72 -22.94 0.88 Allowed 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.182 0.515 . . . . 0.0 110.602 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.436 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 33.0 t -67.07 -55.04 19.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.646 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.56 ' HB3' ' HE2' ' A' ' 89' ' ' MET . . . -61.97 -57.07 13.11 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.42 HG13 ' H ' ' A' ' 106' ' ' ASN . 5.2 p -59.65 -58.65 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.42 ' H ' HG13 ' A' ' 105' ' ' VAL . 4.8 t30 -56.72 -30.12 63.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.709 0.29 . . . . 0.0 111.31 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.496 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 1.2 t80 -58.96 -35.18 72.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.128 0.489 . . . . 0.0 110.308 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.411 ' HG ' ' HE1' ' A' ' 89' ' ' MET . 91.8 mt -53.05 -14.37 0.6 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.898 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.01 6.23 11.95 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.7 p -121.59 -63.49 1.31 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.667 0.27 . . . . 0.0 111.506 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 23.6 p80 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 117.946 -1.026 . . . . 0.0 111.573 -179.784 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.768 0.318 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.87 20.42 8.02 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.158 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -165.44 -10.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.728 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -86.04 -52.11 5.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.919 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -99.79 15.53 26.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.9 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -55.15 -23.91 23.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.064 0.459 . . . . 0.0 110.498 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -159.87 138.77 10.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.403 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 62.6 t -127.58 -27.23 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.277 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -143.13 -0.85 1.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 111.176 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.417 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 54.3 ttt180 -95.12 146.94 23.95 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.417 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 13.9 t70 77.81 -38.38 0.26 Allowed 'General case' 0 C--N 1.331 -0.207 0 O-C-N 123.519 0.512 . . . . 0.0 111.196 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.6 p -53.99 113.03 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-O 121.299 0.571 . . . . 0.0 110.914 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.6 t -171.39 -38.07 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.125 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 24.6 p -148.06 8.28 0.84 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.135 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.48 -1.41 58.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.453 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.51 HD11 ' H ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -46.73 -22.33 0.29 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.004 -179.652 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.51 ' H ' HD11 ' A' ' 16' ' ' LEU . 54.8 m -47.61 -36.51 10.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.849 0.356 . . . . 0.0 110.488 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -176.42 94.84 0.05 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.423 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 4.8 mmt -133.39 -43.51 0.85 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.312 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 140.77 -118.24 1.37 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.403 -0.904 . . . . 0.0 112.994 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -101.82 -23.98 14.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.636 0.255 . . . . 0.0 111.341 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 23' ' ' ALA . 10.0 pt-20 -63.3 -42.31 99.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.191 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.467 ' N ' ' HG3' ' A' ' 22' ' ' GLU . . . -97.54 15.4 23.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.415 -179.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.468 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 2.3 t80 -63.42 -45.19 92.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.153 0.501 . . . . 0.0 110.817 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.463 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 7.2 mm-40 -63.41 -56.04 30.34 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.536 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.2 Cg_endo -55.6 -14.52 10.26 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 121.712 1.608 . . . . 0.0 110.643 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.531 HD23 HG13 ' A' ' 46' ' ' ILE . 1.4 tp -86.47 -40.26 15.48 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.373 -1.285 . . . . 0.0 109.212 178.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.576 HD11 HD11 ' A' ' 31' ' ' LEU . 31.8 tp -75.15 -22.49 58.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.297 179.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -69.0 -29.68 67.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.612 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 63.8 m -65.09 -27.71 68.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.41 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.682 ' HB3' ' HZ2' ' A' ' 60' ' ' LYS . 40.7 mt -65.78 -11.35 45.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.172 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.0 m -100.68 16.38 25.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.645 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -88.93 145.51 25.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -67.79 -27.77 67.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.866 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -75.84 146.21 40.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.933 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 12.2 p90 -87.38 -32.91 19.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.2 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.95 -32.12 73.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.923 0.392 . . . . 0.0 110.37 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.9 mm -81.32 -41.01 18.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.294 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.447 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 40.9 ttm180 -64.06 -48.34 76.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.58 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -57.95 -49.55 73.83 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.791 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.09 -26.98 12.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.642 0.258 . . . . 0.0 111.46 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.427 ' O ' HD12 ' A' ' 27' ' ' LEU . . . -62.82 -56.69 15.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.71 0.29 . . . . 0.0 111.049 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.414 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -65.81 -28.84 69.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.049 0.452 . . . . 0.0 110.777 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.2 m95 -57.01 -39.49 74.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.481 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.8 mt -98.35 -25.73 3.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.772 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.531 HG13 HD23 ' A' ' 27' ' ' LEU . 3.5 tt -57.93 -20.99 15.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.361 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.86 -27.56 64.49 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.692 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.545 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.9 OUTLIER -60.29 -30.46 69.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.715 0.293 . . . . 0.0 111.018 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -104.69 106.01 16.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.509 ' HG2' HG21 ' A' ' 80' ' ' ILE . 2.5 mt-30 -66.93 80.0 0.12 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.08 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -128.18 156.72 42.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.006 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.41 -28.58 69.35 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.927 0.394 . . . . 0.0 110.989 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -69.31 -9.52 53.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.757 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.5 ' HB1' HG12 ' A' ' 46' ' ' ILE . . . -104.85 15.4 27.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.62 -179.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 56.5 t -91.55 -58.1 3.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.118 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.465 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 17.5 tt0 -56.49 -48.87 96.29 Favored Pre-proline 0 CA--C 1.531 0.216 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.515 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 86.0 Cg_exo -42.12 -48.1 6.54 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.396 2.064 . . . . 0.0 112.527 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.533 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . 7.5 mt -62.13 -44.7 96.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.065 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 50.0 mm -53.66 -58.89 2.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.192 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.682 ' HZ2' ' HB3' ' A' ' 31' ' ' LEU . 3.7 pttt -70.16 -18.93 63.22 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.634 ' HG ' HG13 ' A' ' 69' ' ' VAL . 2.9 tp -89.52 -32.71 17.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.688 HD12 HD13 ' A' ' 92' ' ' LEU . 14.2 mt -64.82 -10.49 28.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.127 0.489 . . . . 0.0 110.381 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -114.26 -2.18 13.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.113 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -61.21 -30.23 70.3 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.134 0.493 . . . . 0.0 111.055 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 54.39 27.15 7.77 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.913 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.487 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.4 t -85.0 -19.36 32.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.943 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 119.86 -110.25 1.78 Allowed Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.48 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -56.92 -26.28 58.95 Favored 'General case' 0 CA--C 1.521 -0.155 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.634 HG13 ' HG ' ' A' ' 61' ' ' LEU . 15.5 t -68.24 -34.11 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.879 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -78.44 -40.85 34.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.838 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 97.3 p -67.03 -38.88 86.7 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.478 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.438 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -53.33 -55.23 25.61 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.6 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.533 ' HB3' ' HA ' ' A' ' 58' ' ' LEU . . . -55.72 -32.72 63.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.786 0.327 . . . . 0.0 111.457 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.427 ' HA ' HD23 ' A' ' 62' ' ' LEU . . . -61.78 -63.89 1.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.581 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 72' ' ' GLY . 0.3 OUTLIER -53.62 -32.64 52.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.341 -179.843 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.428 ' HA ' HE21 ' A' ' 79' ' ' GLN . 17.9 t -56.2 -40.28 73.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 110.865 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.552 HD12 HD11 ' A' ' 62' ' ' LEU . 20.0 mt -62.76 -58.52 7.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -50.4 -35.62 29.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.732 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.428 HE21 ' HA ' ' A' ' 76' ' ' SER . 46.3 mt-30 -62.67 -37.35 86.08 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.068 0.461 . . . . 0.0 110.148 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.509 HG21 ' HG2' ' A' ' 50' ' ' GLN . 95.1 mt -72.8 -60.27 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.792 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 59.49 98.88 0.01 OUTLIER Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.803 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.5 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 172.99 -169.73 42.88 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.617 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -72.03 -30.27 65.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.93 0.395 . . . . 0.0 110.777 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.557 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -59.51 -50.47 73.77 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.004 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.557 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 16.5 m -70.74 -25.35 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.002 0.429 . . . . 0.0 110.739 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.42 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -55.77 -27.92 53.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.466 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.22 -34.64 32.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.755 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.08 -49.47 76.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.891 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.536 ' HB3' ' HA ' ' A' ' 104' ' ' ALA . 3.2 mmm -60.17 -46.79 88.5 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -53.3 -32.56 49.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.071 178.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -73.67 -31.37 63.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.848 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.688 HD13 HD12 ' A' ' 62' ' ' LEU . 25.6 mt -76.53 -38.65 54.76 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.85 0.357 . . . . 0.0 110.606 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.448 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -53.21 -32.45 48.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.068 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -84.82 -19.98 31.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.695 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.8 p -122.41 38.37 4.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.55 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -41.94 117.36 1.26 Allowed Glycine 0 C--N 1.334 0.434 0 CA-C-N 115.741 -0.663 . . . . 0.0 113.353 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.4 t -157.45 136.31 11.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.822 0.344 . . . . 0.0 111.091 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.16 -144.96 46.79 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.417 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -91.81 -14.55 29.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.792 0.33 . . . . 0.0 110.457 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -53.99 -35.64 62.08 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.231 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.448 ' NE ' ' HA ' ' A' ' 93' ' ' ALA . 13.9 tpt180 -67.53 -55.8 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.095 179.078 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -48.53 -28.11 3.16 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.727 178.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.2 t -78.03 -44.51 27.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.805 -1.088 . . . . 0.0 111.343 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.536 ' HA ' ' HB3' ' A' ' 89' ' ' MET . . . -54.89 -57.92 9.68 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -178.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.435 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 42.2 t -61.06 -58.59 6.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.326 -178.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -56.51 -42.8 78.98 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.439 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 43.1 t80 -62.03 -28.33 69.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.811 0.339 . . . . 0.0 111.606 -178.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 46.5 mt -58.08 -11.87 2.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.627 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -80.21 4.97 15.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.75 0.309 . . . . 0.0 111.07 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.2 p -140.64 -69.97 0.39 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.207 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.007 -0.996 . . . . 0.0 111.567 179.876 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.7 mtt . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.717 0.294 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.15 -15.56 1.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.183 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -110.07 -41.82 4.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.954 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -79.34 179.96 7.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.982 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.4 p30 40.07 84.58 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.025 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -165.94 -38.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.403 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.502 ' HA ' ' HE ' ' A' ' 10' ' ' ARG . 46.0 p-90 -82.81 11.58 5.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.544 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.44 ' O ' ' HB3' ' A' ' 9' ' ' ARG . 5.7 p -53.99 128.79 14.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.4 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.44 ' HB3' ' O ' ' A' ' 8' ' ' VAL . 23.7 tpt180 73.49 -41.35 0.49 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.009 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.502 ' HE ' ' HA ' ' A' ' 7' ' ' TRP . 65.3 mtm180 -56.55 127.95 33.8 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 14.6 t70 78.46 -53.72 0.48 Allowed 'General case' 0 N--CA 1.465 0.309 0 O-C-N 123.695 0.622 . . . . 0.0 111.176 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -64.73 175.96 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.624 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.4 t -156.95 -32.92 0.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.787 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.1 p -53.06 154.64 2.88 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.735 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.07 -69.37 0.72 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.439 ' H ' HD22 ' A' ' 16' ' ' LEU . 2.3 pt? -88.43 -38.51 14.98 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.427 ' H ' HD22 ' A' ' 16' ' ' LEU . 47.3 m -53.79 -52.47 60.15 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 -178.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -144.34 105.44 4.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.931 0.396 . . . . 0.0 110.502 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.519 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -133.41 -43.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.651 -179.202 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.21 -93.84 0.87 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.651 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -128.87 2.7 5.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.666 0.27 . . . . 0.0 111.191 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -82.55 -44.71 15.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.911 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.519 ' HB3' ' HG2' ' A' ' 19' ' ' MET . . . -106.59 14.32 27.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.115 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.485 ' HA ' ' HE3' ' A' ' 19' ' ' MET . 1.0 OUTLIER -50.07 -49.78 50.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.315 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.27 -52.55 60.57 Favored Pre-proline 0 N--CA 1.466 0.374 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.822 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.497 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 71.6 Cg_exo -35.03 -34.75 0.1 Allowed 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 122.453 2.102 . . . . 0.0 112.172 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.438 HD12 ' O ' ' A' ' 23' ' ' ALA . 8.4 mp -73.79 -55.3 6.4 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.01 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.503 HD13 HD13 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -50.36 -37.46 37.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.52 178.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -66.62 -32.62 74.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.86 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.7 m -64.92 -13.75 57.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.117 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.503 HD13 HD13 ' A' ' 28' ' ' LEU . 87.7 mt -68.72 -19.81 64.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.897 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 56.7 m -93.36 7.64 43.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.92 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -79.92 128.1 33.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.669 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -58.88 -23.51 61.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.613 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -75.85 149.19 37.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.778 0.323 . . . . 0.0 110.565 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 38.4 p-90 -94.43 -37.95 11.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.442 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -63.69 -42.27 98.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.788 0.328 . . . . 0.0 111.036 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.6 mt -67.56 -44.61 86.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.867 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.457 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.4 ttm180 -63.31 -23.48 67.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.576 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.33 -61.0 6.07 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.48 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.14 -36.31 8.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.733 0.301 . . . . 0.0 111.402 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.409 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.56 -54.71 39.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.906 0.384 . . . . 0.0 110.861 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.8 -30.5 71.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.327 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.3 m95 -70.8 -31.2 67.88 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 61.7 mt -99.6 -27.02 3.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.873 0.368 . . . . 0.0 111.648 -178.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.587 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.1 tt -60.85 -28.88 44.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.699 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.541 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -69.89 -4.06 46.13 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.937 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.479 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.9 OUTLIER -69.82 -40.22 76.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.755 0.312 . . . . 0.0 110.196 179.346 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.505 ' C ' ' H ' ' A' ' 51' ' ' ASP . 11.9 m-85 -91.33 119.42 31.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.738 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.42 ' HG2' HD13 ' A' ' 80' ' ' ILE . 1.9 mt-30 -72.78 25.85 0.06 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.48 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.505 ' H ' ' C ' ' A' ' 49' ' ' PHE . 29.2 t70 -83.98 155.33 22.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.908 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -59.07 -33.0 70.29 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.329 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -67.63 -11.96 59.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.865 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.464 ' O ' HD12 ' A' ' 58' ' ' LEU . . . -105.91 -8.45 17.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.036 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.435 ' O ' HG12 ' A' ' 59' ' ' ILE . 96.4 t -91.52 -30.16 4.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.418 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.545 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 17.3 tt0 -60.27 -50.52 85.57 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.587 ' HG2' HD13 ' A' ' 46' ' ' ILE . 74.5 Cg_exo -49.32 -52.37 8.91 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.924 1.75 . . . . 0.0 111.859 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.578 HD22 ' HG ' ' A' ' 77' ' ' LEU . 5.1 mp -56.04 -27.17 52.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.881 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.435 HG12 ' O ' ' A' ' 55' ' ' VAL . 40.4 mm -63.35 -59.54 4.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.739 0.304 . . . . 0.0 111.379 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -70.04 -22.79 63.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.521 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.599 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -65.37 -51.94 57.04 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.941 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.557 HD23 HD23 ' A' ' 92' ' ' LEU . 9.1 mt -51.93 -21.58 3.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.351 . . . . 0.0 111.304 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -104.24 -18.36 14.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.107 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -59.65 -36.06 75.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 111.144 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.479 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 24.7 t70 52.19 30.28 7.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.229 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.462 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.3 t -80.07 -3.07 47.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.217 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.87 -81.56 1.6 Allowed Glycine 0 C--O 1.228 -0.238 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.944 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.64 -47.15 82.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.2 0.524 . . . . 0.0 109.649 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.599 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.2 t -69.04 -45.44 80.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.46 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.479 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 7.0 tmm_? -64.32 -62.45 1.6 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.873 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.7 m -54.07 -30.14 47.01 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.975 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.72 -39.85 94.13 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.41 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.9 -38.85 83.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.638 0.256 . . . . 0.0 111.363 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.63 -54.23 24.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.3 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 75' ' ' ARG . 4.0 ptp180 -67.96 -42.94 80.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.002 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.541 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 74.6 m -59.21 -31.06 68.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.742 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.578 ' HG ' HD22 ' A' ' 58' ' ' LEU . 69.6 mt -70.67 -60.46 2.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.975 -179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -59.87 -22.51 62.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.147 0.499 . . . . 0.0 110.293 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 75' ' ' ARG . 7.6 tt0 -56.9 -37.49 71.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.56 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.42 HD13 ' HG2' ' A' ' 50' ' ' GLN . 32.2 mm -71.56 -60.22 2.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.963 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.446 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 69.45 80.31 0.26 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.296 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -176.69 179.1 47.85 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.391 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -63.44 -22.39 66.86 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.823 0.345 . . . . 0.0 110.971 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.491 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -62.07 -59.88 4.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.355 -179.598 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.551 HG12 HD22 ' A' ' 77' ' ' LEU . 74.8 t -69.64 -24.09 26.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.94 0.4 . . . . 0.0 110.638 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.425 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 2.7 tmt_? -56.65 -27.44 58.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.072 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -82.67 -31.8 28.46 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.769 0.319 . . . . 0.0 111.079 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.79 -34.51 75.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.422 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.544 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 7.0 mmt -71.17 -47.57 56.91 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.414 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -57.74 -29.85 65.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.031 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -80.07 -32.7 39.29 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.935 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.557 HD23 HD23 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -80.81 -26.08 37.37 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.022 0.439 . . . . 0.0 109.847 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.02 -21.67 65.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.526 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -80.22 -27.21 38.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.675 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.1 p -118.44 24.27 11.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.387 178.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.435 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -56.85 119.65 16.59 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.549 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.4 t -144.58 130.4 19.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.836 0.351 . . . . 0.0 110.894 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.44 -130.08 11.84 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.824 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -87.0 -26.51 23.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.571 0.225 . . . . 0.0 111.267 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.48 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.42 -37.49 62.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.859 0.362 . . . . 0.0 111.5 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.435 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 35.4 ttp180 -66.56 -58.46 5.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.707 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 57.9 tttp -46.23 -24.31 0.45 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.191 0.52 . . . . 0.0 110.79 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 45.2 t -71.93 -59.74 3.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.634 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.51 ' HA ' ' SD ' ' A' ' 89' ' ' MET . . . -56.34 -51.79 66.95 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 15.5 t -62.27 -63.74 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -55.36 -39.3 69.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.544 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 31.0 t80 -61.57 -31.73 71.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 120.808 0.337 . . . . 0.0 111.441 -178.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 58.5 mt -57.38 -12.19 2.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.61 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.86 -12.2 60.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.865 0.364 . . . . 0.0 110.993 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 73.0 p -113.7 -62.62 1.57 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.309 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.152 -0.927 . . . . 0.0 110.805 -179.971 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.752 0.311 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 62.42 14.47 6.94 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.305 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -111.54 -49.22 3.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.823 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -89.4 -40.46 12.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.985 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -80.21 99.51 7.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.101 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -173.43 -46.47 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.67 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.3 p-90 -97.0 11.96 34.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.87 -38.16 79.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.023 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 74.2 mtt180 -110.92 -65.68 1.15 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.589 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.546 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 80.2 mtm180 -52.96 152.72 3.82 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.546 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 6.4 m-20 78.1 -38.6 0.25 Allowed 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.522 0.514 . . . . 0.0 111.758 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 52.4 t -68.9 -76.9 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.548 0.213 . . . . 0.0 111.319 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.2 t -169.57 178.04 4.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.974 0.416 . . . . 0.0 111.282 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.543 ' HB ' ' HA ' ' A' ' 18' ' ' ARG . 47.7 p -126.88 119.57 27.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.481 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.624 ' H ' ' H ' ' A' ' 20' ' ' GLY . . . -95.67 -73.94 0.57 Allowed 'General case' 0 C--O 1.231 0.13 0 C-N-CA 120.203 -0.599 . . . . 0.0 112.203 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.5 tp -91.28 -69.71 0.72 Allowed 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.398 -0.521 . . . . 0.0 111.347 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 59.3 p -92.66 -52.91 4.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.01 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.543 ' HA ' ' HB ' ' A' ' 14' ' ' THR . 32.4 ttm180 175.9 28.32 0.0 OUTLIER 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.185 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.551 ' HB3' ' HB3' ' A' ' 22' ' ' GLU . 1.5 mtp -89.62 -44.23 10.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.101 -178.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.624 ' H ' ' H ' ' A' ' 15' ' ' ALA . . . 83.95 -85.88 1.53 Allowed Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.555 -0.831 . . . . 0.0 113.096 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.76 2.31 55.5 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.551 ' HB3' ' HB3' ' A' ' 19' ' ' MET . 9.9 tp10 -106.55 -22.91 12.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.82 0.343 . . . . 0.0 110.935 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HB2' ' HB3' ' A' ' 15' ' ' ALA . . . -96.63 3.12 52.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.181 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.551 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.4 t80 -60.61 -48.59 81.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.969 0.414 . . . . 0.0 110.243 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -63.45 -56.99 22.03 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.965 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.51 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 88.0 Cg_exo -43.04 -28.82 1.38 Allowed 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.365 2.043 . . . . 0.0 111.624 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.551 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 65.3 mt -68.76 -55.02 12.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.298 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.499 HD12 HD11 ' A' ' 31' ' ' LEU . 18.7 tp -67.88 -18.82 64.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.513 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -79.04 -42.8 25.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.964 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.1 p -66.48 -13.7 61.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.395 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.499 HD11 HD12 ' A' ' 28' ' ' LEU . 87.3 mt -67.51 -7.4 25.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.244 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.8 p -95.7 15.33 20.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.561 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -95.01 136.93 34.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -67.3 -1.87 5.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.025 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -84.59 153.24 23.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.77 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.4 p-90 -104.43 -38.64 6.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.954 0.407 . . . . 0.0 110.53 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.42 ' HG3' HG13 ' A' ' 38' ' ' ILE . 13.7 ptm180 -62.82 -39.03 93.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.79 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.42 HG13 ' HG3' ' A' ' 37' ' ' ARG . 50.8 mt -79.36 -47.99 21.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.934 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.472 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 38.3 ttm180 -63.5 -28.51 70.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.601 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.69 -59.02 6.37 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.423 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.14 -29.63 22.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.741 0.305 . . . . 0.0 110.976 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.67 -55.49 23.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.412 ' O ' HG22 ' A' ' 46' ' ' ILE . . . -69.48 -22.89 63.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.193 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.1 m95 -66.12 -28.31 68.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.614 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.8 mt -99.6 -23.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.71 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.412 HG22 ' O ' ' A' ' 43' ' ' ALA . 0.6 OUTLIER -61.08 -32.69 53.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.503 -179.248 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.62 -16.58 63.52 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.552 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.548 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.9 OUTLIER -68.97 -27.04 65.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.837 0.351 . . . . 0.0 110.681 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.442 ' C ' ' H ' ' A' ' 51' ' ' ASP . 56.5 m-85 -99.05 112.77 24.81 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.801 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.642 ' H ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -77.98 36.58 0.23 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.817 179.473 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.442 ' H ' ' C ' ' A' ' 49' ' ' PHE . 33.9 t70 -95.37 165.53 12.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.992 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.48 -31.31 72.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.518 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.433 ' HB3' ' CE2' ' A' ' 24' ' ' PHE . 41.5 ttm180 -69.17 -14.15 62.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.425 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.37 5.19 31.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.031 0.444 . . . . 0.0 110.641 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.639 ' HA ' ' NH2' ' A' ' 84' ' ' ARG . 98.9 t -87.03 -46.9 16.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.804 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.451 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 34.2 tt0 -60.34 -48.25 94.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.451 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 81.0 Cg_exo -42.14 -52.09 4.36 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.405 2.07 . . . . 0.0 112.817 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.473 HD21 ' HA ' ' A' ' 73' ' ' ALA . 6.8 mt -60.62 -37.0 79.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.333 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.9 mm -55.21 -59.43 2.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.477 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.19 -15.77 62.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.24 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.763 HD22 ' H ' ' A' ' 73' ' ' ALA . 0.4 OUTLIER -74.14 -52.66 11.85 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -178.892 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.49 HD23 HD21 ' A' ' 92' ' ' LEU . 7.9 mt -57.06 -10.34 1.12 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.306 -179.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -111.99 -13.44 13.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.618 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -61.14 -32.23 71.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.799 0.333 . . . . 0.0 111.78 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.511 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 32.9 m-20 48.26 32.12 2.98 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.07 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.444 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 29.3 t -83.07 -24.42 32.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.494 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.43 -85.39 0.39 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.95 -0.643 . . . . 0.0 111.556 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.89 -42.43 99.77 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.646 HG13 ' HG ' ' A' ' 61' ' ' LEU . 13.6 t -69.33 -56.86 10.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.056 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.511 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 7.3 tmm_? -54.67 -51.65 64.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.544 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.6 m -63.96 -19.92 65.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.377 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.49 -65.12 3.65 Favored Glycine 0 C--O 1.228 -0.222 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.572 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.763 ' H ' HD22 ' A' ' 61' ' ' LEU . . . -49.77 -31.23 11.06 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.63 -46.54 73.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.788 0.328 . . . . 0.0 111.35 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 6.8 ptp180 -82.23 -24.45 34.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.853 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.527 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 49.6 m -63.52 -38.94 93.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.512 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.6 mt -58.92 -59.96 4.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.137 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.449 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 38.8 mt-10 -46.23 -32.67 3.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.132 179.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.527 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 20.6 mt-30 -70.81 -41.5 71.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.348 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.476 HD12 ' HE ' ' A' ' 84' ' ' ARG . 59.9 mt -75.28 -61.43 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.86 -179.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.429 ' HA2' HG22 ' A' ' 85' ' ' VAL . . . 65.64 168.51 2.36 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.673 -0.775 . . . . 0.0 113.006 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.58 -170.59 24.4 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.895 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -64.89 -24.48 67.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.156 0.503 . . . . 0.0 110.419 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.639 ' NH2' ' HA ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER -54.83 -62.37 1.7 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.63 179.719 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.677 HG22 ' HH ' ' A' ' 107' ' ' TYR . 16.1 m -63.22 -24.75 36.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.27 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.457 ' HD3' ' HE2' ' A' ' 89' ' ' MET . 0.2 OUTLIER -54.62 -33.36 60.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.366 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.21 -24.27 24.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.713 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.431 ' HB3' ' NH1' ' A' ' 84' ' ' ARG . . . -70.27 -49.06 53.72 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.457 ' HE2' ' HD3' ' A' ' 86' ' ' ARG . 0.7 OUTLIER -70.18 -30.51 67.65 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.639 0.257 . . . . 0.0 110.888 -179.14 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -69.8 -43.4 72.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.7 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -67.91 -28.99 67.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.716 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.49 HD21 HD23 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -86.33 -27.84 24.06 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.999 179.702 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.9 -22.91 65.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.578 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -80.23 -26.67 38.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.494 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 59.8 p -122.65 23.58 9.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.374 0.606 . . . . 0.0 109.471 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.527 ' HA3' ' HG2' ' A' ' 101' ' ' ARG . . . -58.31 124.94 38.02 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 115.036 -0.984 . . . . 0.0 113.128 -179.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.406 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 2.3 t -141.23 130.15 23.13 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.72 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 62.63 -140.18 45.85 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.406 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 70' ' ' ARG . 62.2 t80 -62.07 -35.5 78.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.758 0.313 . . . . 0.0 110.66 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.473 ' HB3' ' HD3' ' A' ' 70' ' ' ARG . . . -54.44 -36.53 64.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.253 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.527 ' HG2' ' HA3' ' A' ' 96' ' ' GLY . 1.3 tmt_? -68.83 -61.78 1.66 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.466 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -52.11 -22.53 4.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.295 -179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.1 t -67.07 -53.15 36.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.536 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.431 ' O ' HD22 ' A' ' 108' ' ' LEU . . . -54.81 -62.61 1.54 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.068 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.494 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 23.5 t -54.78 -57.67 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.397 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.14 -32.5 66.43 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.677 ' HH ' HG22 ' A' ' 85' ' ' VAL . 34.9 t80 -63.3 -25.35 68.27 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 120.759 0.314 . . . . 0.0 111.161 -178.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.494 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.8 mm? -50.91 -26.89 6.46 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.01 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -53.91 -13.58 0.79 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.36 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 34.7 p -119.75 -87.49 0.64 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.305 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.624 ' HB2' ' HH ' ' A' ' 107' ' ' TYR . 15.7 m-70 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.952 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.0 mmt . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.78 0.324 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.72 -36.72 18.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.372 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -75.6 167.69 21.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.139 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -90.1 51.63 2.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.086 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.6 p30 41.53 84.32 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.779 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -128.13 -18.9 4.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.577 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -117.08 51.36 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.835 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.8 p -166.98 -24.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.409 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -119.45 -30.42 4.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.919 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 46.3 ttt180 -59.82 135.05 57.57 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.464 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 20.6 t70 75.03 -20.9 0.32 Allowed 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.399 0.437 . . . . 0.0 111.544 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.445 ' H ' ' C ' ' A' ' 10' ' ' ARG . 74.1 t -66.16 -73.16 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.342 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.8 t 62.9 -83.09 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.023 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.6 p -59.64 169.64 1.29 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.805 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 19' ' ' MET . . . -95.88 -69.83 0.74 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -87.68 -26.6 22.9 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.7 t -59.05 -51.85 68.27 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.949 0.404 . . . . 0.0 110.504 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.59 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 3.2 mmp_? -148.21 112.98 5.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.987 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.626 ' HB2' ' HB3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -133.46 -44.41 0.83 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.797 -178.961 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.51 ' H ' ' HG2' ' A' ' 19' ' ' MET . . . 62.6 84.66 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.909 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.489 ' H ' ' HE2' ' A' ' 49' ' ' PHE . 19.0 t70 67.43 9.02 6.71 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.626 ' HB3' ' HB2' ' A' ' 19' ' ' MET . 12.6 tp10 -103.98 -45.09 4.85 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.186 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.43 ' H ' ' HG3' ' A' ' 19' ' ' MET . . . -107.02 17.86 22.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.895 0.378 . . . . 0.0 110.91 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.437 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 0.4 OUTLIER -52.62 -48.27 66.47 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.021 179.464 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.514 ' HG3' ' NH1' ' A' ' 53' ' ' ARG . 3.6 mt-10 -62.21 -57.02 25.68 Favored Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.444 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 1.9 Cg_endo -50.72 -19.18 4.85 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.996 1.797 . . . . 0.0 111.498 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.494 HD21 HG13 ' A' ' 46' ' ' ILE . 0.8 OUTLIER -81.63 -39.91 23.72 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.697 179.367 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.598 HD23 ' HB3' ' A' ' 53' ' ' ARG . 10.8 tp -80.26 -22.15 41.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.364 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -73.95 -34.63 64.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.626 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.0 m -66.17 -17.19 64.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.12 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.503 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 51.3 mt -68.23 -6.59 24.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.862 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.1 m -103.19 11.24 37.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.758 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -71.1 142.15 50.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.821 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -59.51 -34.53 72.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.346 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -81.4 144.33 31.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.973 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.1 p90 -87.3 -32.8 19.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.016 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -58.77 -35.62 73.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.468 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.2 mm -80.83 -41.4 19.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.492 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.503 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 29.5 ttm180 -63.26 -20.02 65.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.629 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.81 -62.88 3.58 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.707 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.62 -33.04 2.64 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.644 0.259 . . . . 0.0 111.438 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.426 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.02 -52.75 63.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.916 0.389 . . . . 0.0 110.085 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.451 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -64.47 -28.71 69.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.74 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -66.97 -36.69 82.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.124 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.1 mm -99.29 -22.29 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.528 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.2 tt -61.04 -38.94 80.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -178.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.75 -6.59 17.87 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.256 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.585 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.8 OUTLIER -70.59 -49.77 44.22 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.514 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.489 ' HE2' ' H ' ' A' ' 21' ' ' ASP . 41.3 m-85 -65.69 -26.81 67.94 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.503 ' HG2' HG12 ' A' ' 80' ' ' ILE . 2.0 mt-30 61.07 16.29 6.97 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.783 0.325 . . . . 0.0 111.4 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.439 ' O ' HG21 ' A' ' 55' ' ' VAL . 18.9 t70 -84.11 -178.72 7.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.033 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.41 ' H ' ' CG ' ' A' ' 51' ' ' ASP . 9.8 pt-20 -61.54 -37.24 83.06 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -179.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.598 ' HB3' HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -67.19 -10.6 52.14 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.888 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.98 -9.42 17.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.975 0.417 . . . . 0.0 111.273 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.439 HG21 ' O ' ' A' ' 51' ' ' ASP . 62.5 t -82.02 -47.88 18.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.934 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.466 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 4.7 tp10 -60.1 -48.31 94.76 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.528 ' HG2' HD13 ' A' ' 46' ' ' ILE . 83.9 Cg_exo -43.0 -53.07 4.26 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.289 1.993 . . . . 0.0 112.664 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.495 HD11 HD23 ' A' ' 77' ' ' LEU . 16.3 mt -53.54 -34.22 57.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.046 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 42.9 mm -63.29 -61.15 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.533 ' HG3' HD13 ' A' ' 61' ' ' LEU . 16.8 pttt -72.19 -19.09 61.8 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.533 HD13 ' HG3' ' A' ' 60' ' ' LYS . 1.5 mp -77.77 -51.1 11.07 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.557 ' HB3' ' HB3' ' A' ' 100' ' ' ALA . 69.4 mt -63.43 -9.01 10.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.225 0.536 . . . . 0.0 109.972 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -112.94 -16.23 12.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.478 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.415 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.9 OUTLIER -61.09 -54.44 44.61 Favored 'General case' 0 CA--C 1.517 -0.288 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.307 -179.571 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 12.5 t70 72.02 25.5 3.02 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.738 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.45 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 69.0 m -81.21 -4.92 57.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.993 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.53 -101.84 2.45 Favored Glycine 0 C--O 1.229 -0.193 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.656 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.16 -30.46 37.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.262 0.553 . . . . 0.0 109.928 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.529 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.0 t -73.6 -46.83 46.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.198 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -70.46 -60.51 2.22 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.686 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.6 m -54.16 -28.34 39.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.872 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.88 -37.74 94.85 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.447 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.401 ' HB1' HD22 ' A' ' 61' ' ' LEU . . . -79.8 -37.08 36.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.653 0.263 . . . . 0.0 110.987 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -46.26 -35.06 4.89 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.157 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.405 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 1.2 ptp85 -83.91 -33.51 24.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.652 0.263 . . . . 0.0 111.453 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.442 ' HA ' HE21 ' A' ' 79' ' ' GLN . 66.4 m -57.84 -37.43 73.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.891 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.517 ' HA ' HG13 ' A' ' 85' ' ' VAL . 4.1 mm? -55.33 -61.22 2.48 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 110.95 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -65.25 -24.69 67.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.677 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.442 HE21 ' HA ' ' A' ' 76' ' ' SER . 3.2 tt0 -60.89 -58.49 8.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.8 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.503 HG12 ' HG2' ' A' ' 50' ' ' GLN . 95.4 mt -63.29 -52.02 63.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.101 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 55.39 76.43 0.19 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.663 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -174.68 -179.76 45.48 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.598 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -59.64 -21.48 60.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.951 0.405 . . . . 0.0 110.699 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.522 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 1.2 mpt_? -59.7 -64.33 0.98 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.333 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.517 HG13 ' HA ' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -70.84 -20.59 22.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.931 179.351 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -52.88 -33.09 48.42 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.933 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.55 -26.34 35.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.441 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.17 -45.0 64.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.008 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.578 ' HE3' ' HG ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -68.88 -29.77 68.13 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.488 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -70.82 -31.32 68.01 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.077 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -74.45 -31.4 62.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.191 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.529 HD21 ' HB3' ' A' ' 104' ' ' ALA . 1.7 tp -86.55 -32.23 20.81 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.776 0.322 . . . . 0.0 110.172 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -54.91 -28.06 47.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.162 0.506 . . . . 0.0 110.265 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -83.21 -25.46 31.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.205 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 54.2 p -116.12 32.08 6.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.008 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.554 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -46.51 121.41 5.66 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.307 -0.86 . . . . 0.0 113.771 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.0 m -150.47 130.71 13.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.777 0.322 . . . . 0.0 110.403 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.9 -139.72 28.97 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.348 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -89.6 -18.48 26.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.824 0.345 . . . . 0.0 110.367 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.557 ' HB3' ' HB3' ' A' ' 62' ' ' LEU . . . -54.18 -43.96 71.14 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.594 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.554 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 55.4 ttp180 -51.84 -57.95 7.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.31 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -56.55 -32.15 64.86 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.094 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.551 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 18.9 t -64.14 -41.83 93.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.227 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.529 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -64.51 -57.18 9.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.056 0.455 . . . . 0.0 111.872 -179.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 6.3 p -64.93 -54.26 31.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.879 -178.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.448 ' N ' HG11 ' A' ' 105' ' ' VAL . 5.1 t30 -55.55 -34.36 64.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.588 0.232 . . . . 0.0 111.404 -179.123 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.83 -31.68 68.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.46 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.578 ' HG ' ' HE3' ' A' ' 89' ' ' MET . 1.3 mt -49.96 -20.29 0.89 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.53 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -69.08 5.06 1.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.449 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' THR . . . . . 0.418 ' H ' ' C ' ' A' ' 108' ' ' LEU . 20.8 m -108.48 -72.51 0.72 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.711 0.291 . . . . 0.0 111.329 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 84.4 t60 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.735 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.7 tpt . . . . . 0 N--CA 1.484 1.247 0 CA-C-O 120.851 0.358 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -126.34 26.67 6.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.059 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.7 t70 64.47 9.16 4.79 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.861 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -98.83 -47.92 5.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.729 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -104.86 111.68 24.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.782 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 53.7 mttm -104.32 -43.43 5.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.82 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -97.62 111.84 23.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.4 p -175.94 -24.94 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.282 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -105.56 1.33 27.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.14 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.469 ' C ' ' H ' ' A' ' 12' ' ' VAL . 25.4 ptt180 -51.66 105.7 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.48 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.5 t70 74.81 -26.75 0.19 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.26 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.501 HG11 ' HB2' ' A' ' 17' ' ' SER . 7.0 t -68.09 158.92 5.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.021 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.429 ' N ' HG11 ' A' ' 12' ' ' VAL . 6.7 t -157.59 -156.44 0.58 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.809 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.59 HG21 ' H ' ' A' ' 16' ' ' LEU . 3.2 t 49.08 -170.55 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.044 -0.525 . . . . 0.0 112.093 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.473 ' O ' ' HG2' ' A' ' 18' ' ' ARG . . . -56.99 -41.25 78.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.979 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.59 ' H ' HG21 ' A' ' 14' ' ' THR . 2.7 tm? -49.57 -28.58 5.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.743 0.306 . . . . 0.0 111.041 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.501 ' HB2' HG11 ' A' ' 12' ' ' VAL . 28.0 t -87.18 -27.73 22.85 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 20.9 ptt180 -52.67 -27.27 16.61 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.567 0.222 . . . . 0.0 111.401 -179.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.643 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 72.1 mmm -121.75 -27.32 4.7 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.905 0.383 . . . . 0.0 110.302 178.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 84.6 -122.49 5.9 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.461 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -66.02 -24.69 66.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.847 0.356 . . . . 0.0 110.484 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -77.82 -13.06 60.01 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.643 ' HB2' ' HB2' ' A' ' 19' ' ' MET . . . -94.83 2.57 55.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.619 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.3 t80 -62.26 -40.43 96.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 121.315 0.578 . . . . 0.0 109.526 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.495 ' HG2' ' NH1' ' A' ' 53' ' ' ARG . 43.2 mt-10 -63.41 -56.2 28.92 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.881 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.566 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 77.2 Cg_exo -37.2 -29.23 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.24 0 C-N-CA 122.639 2.226 . . . . 0.0 111.695 179.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 81.7 mt -72.68 -58.41 3.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.588 178.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.52 ' HA ' HD13 ' A' ' 31' ' ' LEU . 49.1 tp -61.27 -24.88 66.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.783 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -79.1 -44.6 21.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.765 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.5 p -65.54 -11.73 46.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.0 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.523 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 43.5 mt -70.21 -6.84 37.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.129 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 77.7 p -111.98 13.89 20.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.776 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.682 HD22 ' HB2' ' A' ' 35' ' ' ASP . 0.8 OUTLIER -69.09 147.67 51.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.017 179.972 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -56.82 -44.12 81.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.395 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.682 ' HB2' HD22 ' A' ' 33' ' ' ASN . 10.9 m-20 -75.85 163.27 27.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.055 0.455 . . . . 0.0 111.388 -179.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -103.72 -29.59 10.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.737 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -63.53 -32.97 74.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.218 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.3 mt -81.16 -41.8 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.847 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.523 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 32.7 ttm180 -61.75 -29.8 70.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.724 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -56.11 -63.25 5.48 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.348 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.27 -29.28 9.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.545 0.212 . . . . 0.0 111.479 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.56 -52.08 59.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.873 0.368 . . . . 0.0 110.531 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.01 -31.35 71.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.687 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -70.7 -28.29 64.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.254 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 81.2 mt -98.76 -27.99 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.841 0.353 . . . . 0.0 111.655 -179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.422 HD11 ' HG2' ' A' ' 57' ' ' PRO . 1.5 tt -60.31 -30.36 46.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.827 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.42 -20.8 63.81 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.939 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -65.79 -23.85 66.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.846 0.355 . . . . 0.0 110.445 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.517 ' C ' ' H ' ' A' ' 51' ' ' ASP . 9.1 m-85 -95.29 109.5 21.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.486 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -71.85 16.66 0.11 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.3 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.517 ' H ' ' C ' ' A' ' 49' ' ' PHE . 37.1 t70 -84.04 161.56 20.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.641 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.91 -28.7 69.13 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.552 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.495 ' NH1' ' HG2' ' A' ' 25' ' ' GLU . 12.7 ttm180 -63.91 -13.95 49.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.024 0.44 . . . . 0.0 110.489 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.405 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -105.19 -10.61 16.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.486 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.408 HG11 ' HB3' ' A' ' 88' ' ' ALA . 68.2 t -82.23 -36.11 13.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.625 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.541 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 3.8 tp10 -60.37 -49.97 87.96 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.274 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.541 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 82.8 Cg_exo -45.14 -51.27 7.89 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.287 1.991 . . . . 0.0 111.892 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.606 HD11 HD21 ' A' ' 77' ' ' LEU . 4.8 mt -54.73 -35.04 63.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.624 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.53 HG23 ' HD2' ' A' ' 91' ' ' LYS . 46.2 mm -60.77 -60.76 2.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.822 0.344 . . . . 0.0 111.566 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -71.48 -10.85 60.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.103 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.533 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.7 mp -88.62 -48.05 7.83 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.495 HD13 HD23 ' A' ' 92' ' ' LEU . 26.5 mt -60.32 -12.31 8.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.971 0.415 . . . . 0.0 110.798 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -113.93 -11.97 12.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.816 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -61.12 -44.95 96.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.101 0.477 . . . . 0.0 111.089 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.624 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 28.5 m-20 66.93 22.22 10.17 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.944 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.482 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 39.6 m -86.38 16.06 4.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.637 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.08 -100.27 0.84 Allowed Glycine 0 C--O 1.227 -0.319 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.857 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -46.86 -40.97 14.97 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.076 0.465 . . . . 0.0 110.741 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.533 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.4 t -71.26 -51.11 36.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.45 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.624 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 53.7 ttp180 -62.3 -60.64 3.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.22 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 88.5 p -53.98 -34.13 58.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.993 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.48 -26.71 57.31 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.056 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.418 ' CB ' ' HA ' ' A' ' 58' ' ' LEU . . . -88.12 -39.77 14.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.787 0.327 . . . . 0.0 110.878 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.07 -34.99 59.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.099 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -80.66 -23.97 39.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.937 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.623 ' HA ' HE21 ' A' ' 79' ' ' GLN . 74.6 m -67.07 -39.07 86.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.291 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.606 HD21 HD11 ' A' ' 58' ' ' LEU . 4.2 mm? -55.36 -57.02 13.58 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.826 0.345 . . . . 0.0 110.565 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.91 -34.75 78.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.363 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.623 HE21 ' HA ' ' A' ' 76' ' ' SER . 0.2 OUTLIER -56.37 -44.61 80.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.254 -179.713 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 92.2 mt -78.22 -59.73 2.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.853 0.359 . . . . 0.0 110.752 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.61 97.77 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.599 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.424 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 170.16 -177.48 43.44 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.484 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -68.83 -30.97 69.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.572 0.225 . . . . 0.0 110.972 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.552 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.57 -53.22 60.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.821 0.343 . . . . 0.0 110.438 179.732 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.552 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -70.82 -24.07 24.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.267 179.311 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 86' ' ' ARG . 18.1 ttt180 -58.84 -38.09 77.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.419 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.32 -22.86 59.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.757 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.408 ' HB3' HG11 ' A' ' 55' ' ' VAL . . . -71.52 -46.83 58.54 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.993 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.6 ' HE3' ' HB3' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -72.23 -32.69 66.94 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.6 179.701 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.477 ' HG3' ' HE2' ' A' ' 89' ' ' MET . 27.1 mt-10 -59.16 -41.46 88.44 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 179.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.53 ' HD2' HG23 ' A' ' 59' ' ' ILE . 9.3 tmtm? -64.49 -23.6 67.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.636 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.495 HD23 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -87.1 -28.37 22.56 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.881 179.223 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.26 -30.97 72.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.317 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.444 ' HG3' HG21 ' A' ' 95' ' ' THR . 13.5 pt-20 -80.15 -18.63 49.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.967 0.413 . . . . 0.0 110.366 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.444 HG21 ' HG3' ' A' ' 94' ' ' GLU . 51.2 p -123.98 25.53 7.9 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -65.89 127.01 30.12 Favored Glycine 0 N--CA 1.443 -0.871 0 CA-C-N 115.011 -0.995 . . . . 0.0 113.343 -178.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.1 t -141.92 131.83 24.44 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.27 -0.465 . . . . 0.0 111.138 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.02 -127.13 42.33 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.821 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.409 ' O ' HG23 ' A' ' 103' ' ' VAL . 52.2 t80 -66.46 -40.02 89.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.596 0.236 . . . . 0.0 111.058 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.52 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -50.67 -41.17 55.25 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.605 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.415 ' CD ' ' HA3' ' A' ' 96' ' ' GLY . 7.9 tpt180 -64.33 -59.11 4.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.092 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -50.02 -23.27 1.95 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.146 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.52 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 13.6 t -66.45 -60.27 2.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.587 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.527 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.26 -53.23 60.41 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 10.2 p -60.79 -50.07 82.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.412 ' N ' HG12 ' A' ' 105' ' ' VAL . 58.1 t30 -70.75 -30.67 67.25 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.431 ' HD2' ' HG2' ' A' ' 89' ' ' MET . 7.4 t80 -64.56 -49.07 72.67 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -177.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.6 ' HB3' ' HE3' ' A' ' 89' ' ' MET . 3.8 pp -55.03 -12.14 0.8 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.238 -178.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -65.87 -30.27 70.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.917 0.389 . . . . 0.0 110.692 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 22.0 p -112.61 -42.24 3.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.161 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 29.9 p80 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.529 -0.748 . . . . 0.0 111.488 179.74 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 ptp . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.89 0.376 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.11 -58.3 2.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.124 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -104.76 106.51 17.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.989 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 57.37 -168.22 0.12 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.181 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.572 ' N ' HD21 ' A' ' 5' ' ' ASN . 0.8 OUTLIER -91.39 67.32 5.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.894 -179.782 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.484 ' C ' ' H ' ' A' ' 8' ' ' VAL . 31.6 mmmt -110.19 159.05 17.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.491 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 68.18 -7.49 0.65 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.862 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.584 ' HB ' ' HG3' ' A' ' 22' ' ' GLU . 1.5 m -47.87 -52.7 6.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.663 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.541 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 38.5 ptt180 -172.21 3.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.262 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.497 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 59.5 mtp180 -62.22 104.83 0.52 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.497 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 6.1 m-20 69.96 4.18 4.67 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.369 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.541 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 19.2 t -89.22 -68.3 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.259 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.8 m 63.53 160.81 0.1 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.092 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 81.9 p 47.39 34.28 3.21 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.007 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 19' ' ' MET . . . -82.58 -2.02 52.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.599 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -49.49 -18.82 0.46 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.55 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 38.4 t -68.01 -50.89 52.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.889 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -139.78 72.39 1.4 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.479 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.517 ' HA ' ' HE2' ' A' ' 19' ' ' MET . 0.0 OUTLIER -134.16 -43.78 0.79 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.931 0.396 . . . . 0.0 110.552 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.77 -77.15 1.65 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.27 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -68.5 -69.44 0.33 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -178.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.584 ' HG3' ' HB ' ' A' ' 8' ' ' VAL . 11.6 mm-40 -62.04 -6.49 2.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.899 0.38 . . . . 0.0 110.65 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.531 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -97.95 -23.17 15.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.392 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.5 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 5.6 t80 -41.96 -55.91 2.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.42 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.41 -58.77 14.11 Favored Pre-proline 0 C--N 1.324 -0.507 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.485 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 66.9 Cg_exo -40.51 -36.5 1.78 Allowed 'Trans proline' 0 C--N 1.361 1.217 0 C-N-CA 122.622 2.214 . . . . 0.0 112.462 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 3.8 mm? -53.03 -57.06 11.66 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.115 0.483 . . . . 0.0 110.282 178.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.444 HD11 HD11 ' A' ' 31' ' ' LEU . 1.1 tp -74.3 -31.51 62.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.693 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 26' ' ' PRO . 43.2 mt-10 -64.53 -29.77 70.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.584 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.0 t -66.38 -17.35 64.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.226 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.444 HD11 HD11 ' A' ' 28' ' ' LEU . 86.9 mt -67.53 -6.38 19.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 110.741 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.4 p -121.95 21.52 10.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -86.02 149.07 25.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.892 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.65 -31.75 73.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.368 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -82.54 163.3 21.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.734 0.302 . . . . 0.0 110.918 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -110.89 -41.75 4.17 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.476 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -58.9 -29.44 67.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.05 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.14 -42.86 27.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.718 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.495 ' HD2' HG23 ' A' ' 69' ' ' VAL . 33.7 ttm180 -61.99 -20.45 63.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.305 179.457 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.89 -66.26 2.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.282 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.69 -28.27 5.77 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.693 0.282 . . . . 0.0 111.216 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.507 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -62.57 -56.99 12.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.498 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.471 ' HB3' HD22 ' A' ' 61' ' ' LEU . . . -63.68 -31.54 72.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.785 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -70.87 -34.31 71.49 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.784 -178.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.4 mt -99.24 -21.22 5.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.851 0.358 . . . . 0.0 111.852 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.507 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 7.0 tt -61.06 -33.41 55.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -69.51 -22.46 76.53 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.663 -0.78 . . . . 0.0 113.152 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -70.81 -10.95 60.58 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -84.57 -34.82 23.13 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.664 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.3 OUTLIER 59.74 47.09 10.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.977 0.418 . . . . 0.0 110.952 -179.67 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.42 ' O ' HG23 ' A' ' 55' ' ' VAL . 10.8 t70 -127.5 178.84 5.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.19 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -60.81 -43.89 97.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.99 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 24' ' ' PHE . 15.6 mmt180 -64.47 -10.81 27.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.724 0.297 . . . . 0.0 111.224 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.23 5.47 32.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.642 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 51' ' ' ASP . 94.6 t -90.7 -55.65 6.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.123 -179.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.452 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 31.9 tt0 -57.64 -48.87 96.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.477 ' HG2' HD11 ' A' ' 46' ' ' ILE . 80.2 Cg_exo -42.64 -53.3 3.91 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.379 2.053 . . . . 0.0 112.619 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.543 HD11 HD22 ' A' ' 77' ' ' LEU . 12.3 mt -54.27 -38.77 66.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.71 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 51.0 mm -60.71 -60.2 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -70.1 -7.78 44.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.89 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.631 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.0 OUTLIER -89.49 -42.85 11.23 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.507 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.551 HD12 HD21 ' A' ' 92' ' ' LEU . 8.1 mt -62.13 -9.36 7.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.257 0.551 . . . . 0.0 110.256 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -123.82 -4.79 8.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.635 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.477 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 25.5 t0 -61.06 -29.16 69.57 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.148 0.499 . . . . 0.0 111.107 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.665 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 12.3 t70 55.13 26.24 8.03 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.473 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.482 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 45.9 t -86.28 -3.38 58.97 Favored 'General case' 0 C--N 1.334 -0.104 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.127 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.12 -70.87 2.71 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.867 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.99 -54.53 14.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.216 0.532 . . . . 0.0 109.636 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.631 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.5 t -68.86 -30.31 46.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.272 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.665 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 41.7 ttt180 -71.45 -63.29 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.819 0.342 . . . . 0.0 111.079 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.5 m -61.81 -21.29 64.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.269 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -65.19 -22.17 68.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.341 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.404 ' O ' ' N ' ' A' ' 76' ' ' SER . . . -88.46 -49.85 6.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -44.16 -32.63 1.28 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.727 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 75' ' ' ARG . 6.2 ptp180 -79.75 -34.18 40.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 0.0 110.969 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.439 ' HB2' HD21 ' A' ' 58' ' ' LEU . 70.9 m -63.77 -35.99 82.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.453 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.543 HD22 HD11 ' A' ' 58' ' ' LEU . 3.9 mm? -55.46 -59.13 5.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.836 0.35 . . . . 0.0 110.318 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.453 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 34.3 tt0 -63.6 -26.37 68.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.948 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.41 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 8.2 mt-30 -62.32 -51.2 68.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.63 179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.664 HG12 ' HG3' ' A' ' 50' ' ' GLN . 69.0 mt -65.73 -55.59 18.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.681 179.576 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.541 ' HA2' ' HH ' ' A' ' 107' ' ' TYR . . . 65.78 116.67 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.716 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 149.5 177.34 23.5 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.431 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -63.11 -22.41 66.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.815 0.34 . . . . 0.0 110.976 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.476 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -63.09 -58.76 6.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.388 -179.811 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.469 ' H ' ' HG2' ' A' ' 84' ' ' ARG . 4.2 m -70.48 -22.93 24.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.927 0.394 . . . . 0.0 111.288 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -58.71 -35.16 72.21 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.944 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.71 -29.05 67.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.287 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.7 70.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.691 179.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.559 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 17.7 mmm -68.51 -51.72 39.98 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.38 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -54.95 -35.96 64.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.904 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.6 tmtm? -77.73 -25.91 49.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.491 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.551 HD21 HD12 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -86.59 -21.56 26.75 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.156 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.73 -21.13 59.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.725 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -80.35 -24.79 39.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.286 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 81.4 p -122.55 14.82 10.28 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.423 ' C ' ' HB2' ' A' ' 101' ' ' ARG . . . -61.24 128.27 43.88 Favored Glycine 0 N--CA 1.444 -0.782 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.989 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.478 HG21 HH22 ' A' ' 70' ' ' ARG . 4.3 t -139.82 130.16 25.38 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.916 0.389 . . . . 0.0 111.169 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.06 -108.84 2.44 Favored Glycine 0 CA--C 1.519 0.302 0 C-N-CA 121.113 -0.565 . . . . 0.0 113.282 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.42 ' O ' HG22 ' A' ' 103' ' ' VAL . 53.3 t80 -85.6 -40.35 16.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.655 0.264 . . . . 0.0 111.541 -179.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.443 ' O ' HD22 ' A' ' 92' ' ' LEU . . . -48.43 -38.1 18.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 112.059 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.423 ' HB2' ' C ' ' A' ' 96' ' ' GLY . 42.5 ttt180 -73.82 -56.49 4.91 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.484 ' HG3' ' ND2' ' A' ' 106' ' ' ASN . 2.2 tpmt? -46.67 -21.71 0.22 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.179 0.514 . . . . 0.0 110.813 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 99' ' ' PHE . 37.5 t -74.49 -59.69 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.912 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.444 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.37 -44.48 84.44 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.404 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 51.7 t -63.9 -64.07 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -177.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.484 ' ND2' ' HG3' ' A' ' 102' ' ' LYS . 91.8 m-20 -60.21 -37.57 80.7 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.559 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 24.8 t80 -60.74 -32.42 71.7 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 120.789 0.328 . . . . 0.0 111.074 -178.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 35.6 mt -54.19 -18.24 3.63 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.534 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -71.94 1.62 6.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.099 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 18.9 m -114.24 -80.09 0.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.187 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 61.0 m80 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.948 -179.966 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.3 tpt . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.846 0.355 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.85 -66.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.252 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -117.84 -83.1 0.64 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.117 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -159.03 47.99 0.32 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.925 0.393 . . . . 0.0 110.629 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.2 t30 60.55 10.26 2.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.923 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.527 ' HB2' ' HZ3' ' A' ' 6' ' ' LYS . 4.5 ttmp? -66.67 145.91 55.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.545 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.47 ' O ' HG13 ' A' ' 8' ' ' VAL . 0.3 OUTLIER 74.36 -37.45 0.36 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.566 0.541 . . . . 0.0 110.949 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.47 HG13 ' O ' ' A' ' 7' ' ' TRP . 0.3 OUTLIER 50.23 175.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-O 121.591 0.71 . . . . 0.0 112.774 178.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.461 ' H ' HG22 ' A' ' 8' ' ' VAL . 14.7 mmm180 -91.29 44.65 1.2 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.794 -179.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.626 ' HA ' ' HG2' ' A' ' 22' ' ' GLU . 42.7 ttt180 -61.89 104.51 0.46 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 67.93 14.71 9.44 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.103 0.477 . . . . 0.0 109.971 -178.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 28.6 t -96.75 77.82 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.501 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.7 t 64.24 120.32 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.471 179.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 29.5 p 57.84 139.06 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.825 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.26 -66.67 0.89 Allowed 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.484 HD11 ' H ' ' A' ' 16' ' ' LEU . 1.7 mp -86.16 -11.77 51.66 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.0 t -44.8 -52.73 8.18 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 174.54 40.64 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.487 ' HB3' ' HB3' ' A' ' 22' ' ' GLU . 23.0 mmt -74.57 -6.71 50.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.782 0.325 . . . . 0.0 110.908 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.57 -105.49 1.08 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.911 -0.661 . . . . 0.0 113.115 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.12 -38.45 73.47 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.695 0.283 . . . . 0.0 111.368 -179.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.626 ' HG2' ' HA ' ' A' ' 10' ' ' ARG . 21.3 tp10 -80.65 -18.22 48.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.079 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.518 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -96.94 -2.95 42.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.702 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.477 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 11.7 t80 -54.71 -59.98 3.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.342 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.41 -55.56 34.38 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.106 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.518 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 98.5 Cg_exo -42.43 -31.66 1.93 Allowed 'Trans proline' 0 C--N 1.36 1.174 0 C-N-CA 122.298 1.998 . . . . 0.0 111.74 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 33.5 mt -67.91 -58.62 4.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.305 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.533 HD13 HD11 ' A' ' 31' ' ' LEU . 13.7 tp -62.06 -21.92 65.33 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.376 179.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -77.2 -27.47 53.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.634 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.457 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 74.1 m -64.43 -25.81 68.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.977 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.657 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 87.9 mt -65.27 -17.05 64.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.806 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.0 m -102.4 16.37 26.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.107 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.457 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 92.4 m-20 -95.29 143.88 26.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.995 0.426 . . . . 0.0 111.26 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -67.78 -16.51 64.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.903 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -85.33 160.7 19.75 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.66 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 7.3 p90 -109.17 -35.96 6.17 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.455 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.422 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 71.3 ttt180 -60.26 -32.07 70.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.824 0.345 . . . . 0.0 111.224 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 59.3 mt -82.43 -38.39 15.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.501 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.657 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 43.1 ttm180 -64.58 -46.79 81.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.423 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -59.49 -47.89 88.65 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.67 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.93 -27.96 54.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.716 0.293 . . . . 0.0 111.253 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.445 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.33 -56.42 22.36 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.038 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.54 -28.54 69.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.948 0.404 . . . . 0.0 110.801 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.3 m95 -55.4 -42.87 74.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.228 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.8 mt -99.08 -20.37 5.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.545 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.498 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.2 OUTLIER -56.81 -37.33 53.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.58 -179.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.01 -20.5 60.26 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.93 -0.653 . . . . 0.0 113.399 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -69.83 -21.12 63.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -82.61 -27.74 31.27 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.609 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.0 OUTLIER 57.66 27.25 13.99 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.94 0.4 . . . . 0.0 111.38 179.828 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -100.96 158.38 16.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.162 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -56.77 -36.75 70.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.477 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.527 ' HD2' ' O ' ' A' ' 53' ' ' ARG . 0.8 OUTLIER -63.73 -27.55 69.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.891 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.498 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -96.11 0.14 50.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.228 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.6 t -90.83 -41.05 13.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.392 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.542 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 19.1 tt0 -60.61 -49.18 91.02 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 50.5 Cg_exo -54.03 -17.35 10.93 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.647 2.231 . . . . 0.0 113.222 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.47 HD22 ' HA ' ' A' ' 73' ' ' ALA . 12.9 mt -86.54 -31.79 21.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.844 0.354 . . . . 0.0 110.93 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.6 mm -63.33 -52.62 56.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.984 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -70.17 -44.55 68.54 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.592 ' HG ' HG13 ' A' ' 69' ' ' VAL . 2.0 tp -57.66 -35.74 70.96 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -177.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.572 HD13 HD23 ' A' ' 92' ' ' LEU . 35.2 mt -59.01 -12.08 4.22 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -113.08 -3.6 13.96 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.98 -33.62 73.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.153 0.501 . . . . 0.0 111.117 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.545 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 17.9 t70 50.34 26.77 2.4 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.373 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.461 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.6 t -82.37 -17.34 45.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.943 0.401 . . . . 0.0 110.372 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 122.2 -114.45 2.5 Favored Glycine 0 N--CA 1.452 -0.254 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.444 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.422 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -55.06 -27.94 48.53 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.376 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.592 HG13 ' HG ' ' A' ' 61' ' ' LEU . 39.5 t -64.92 -38.94 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.621 178.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.545 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 44.1 ttp180 -74.69 -40.15 61.55 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.595 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 55.0 m -64.85 -33.74 76.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.09 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.35 -60.35 8.67 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.444 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.47 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -57.12 -31.53 65.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.872 0.368 . . . . 0.0 111.048 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.97 -59.05 5.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.737 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -67.11 -37.51 84.0 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.098 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.418 ' O ' ' HB3' ' A' ' 79' ' ' GLN . 60.7 p -53.29 -40.22 64.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.752 0.31 . . . . 0.0 111.237 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.419 ' HB3' HG12 ' A' ' 85' ' ' VAL . 35.2 mt -67.7 -60.17 2.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.828 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -53.18 -25.8 15.0 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.111 0.481 . . . . 0.0 110.219 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.433 HE21 ' HB3' ' A' ' 79' ' ' GLN . 4.7 tt0 -68.23 -41.55 81.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.066 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.609 HG12 ' HG3' ' A' ' 50' ' ' GLN . 89.3 mt -63.13 -55.4 23.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.727 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.509 ' HA2' ' HH ' ' A' ' 107' ' ' TYR . . . 66.24 119.34 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.57 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.77 -179.97 27.92 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.278 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -66.38 -33.96 76.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.72 0.295 . . . . 0.0 110.922 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.472 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -62.97 -38.31 90.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.11 -179.78 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.445 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 19.8 t -64.8 -37.16 79.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.819 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 39.4 ttp180 -59.19 -27.36 65.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.513 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.29 76.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.025 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.65 88.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.929 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.52 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 14.4 mmt -66.77 -49.41 65.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.691 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -56.42 -34.98 67.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.82 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.14 -27.59 48.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.985 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.572 HD23 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -86.17 -19.79 29.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.16 0.505 . . . . 0.0 109.745 179.663 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.69 -19.95 60.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.692 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.51 -27.6 37.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.332 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 15.6 p -120.18 18.3 12.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.333 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -53.48 125.92 33.12 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.968 -1.015 . . . . 0.0 113.268 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.4 t -139.79 130.32 25.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.035 0.445 . . . . 0.0 110.845 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.23 -121.29 26.17 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.005 -0.617 . . . . 0.0 113.132 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -75.87 -36.53 59.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.66 0.267 . . . . 0.0 111.685 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.475 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.84 -39.72 59.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.871 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -66.33 -59.98 3.2 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.485 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -45.7 -32.85 2.64 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.869 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 19.9 t -58.98 -59.92 3.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.656 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.477 ' HA ' ' SD ' ' A' ' 89' ' ' MET . . . -58.33 -56.4 22.56 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 88.6 t -59.46 -60.68 2.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -178.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -55.4 -37.42 67.58 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.52 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 43.5 t80 -62.84 -22.77 66.9 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 120.907 0.384 . . . . 0.0 110.958 -178.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.4 mt -58.39 -17.21 18.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.166 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -64.79 -24.08 67.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.662 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.1 p -102.39 -58.01 1.95 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.818 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 44.1 m80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.295 -0.86 . . . . 0.0 110.835 179.891 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.7 mmm . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.821 0.344 . . . . 0.0 110.948 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.18 6.45 1.53 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.096 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 60.25 11.89 3.06 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.255 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -145.49 -46.82 0.22 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.138 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -76.94 79.3 3.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.054 0.454 . . . . 0.0 111.555 -179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -115.49 56.51 0.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.019 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 15.0 m95 63.33 15.99 9.13 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.115 -179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.2 t -80.56 -51.09 16.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.861 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.516 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 99.1 mtt180 -137.26 -12.14 1.63 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.871 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.449 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 0.6 OUTLIER -61.48 104.29 0.4 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.262 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.449 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 27.1 t70 74.81 -19.34 0.39 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.283 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.516 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 60.4 t -56.25 -65.9 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.614 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.9 t 68.04 -81.07 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.382 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 46.7 p -112.08 95.05 5.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.883 0.373 . . . . 0.0 111.515 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.543 ' HB3' ' HB2' ' A' ' 19' ' ' MET . . . -95.74 -2.54 47.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.371 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.477 ' H ' HD12 ' A' ' 16' ' ' LEU . 4.7 mp -56.92 -18.64 14.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.93 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 52.3 m -47.67 -52.1 19.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.484 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 174.49 7.43 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.745 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.543 ' HB2' ' HB3' ' A' ' 15' ' ' ALA . 11.3 mtp -61.65 -41.64 97.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.126 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.3 170.92 16.18 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.73 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.3 t70 62.37 -80.11 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.9 0.381 . . . . 0.0 110.843 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.82 -13.65 59.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.393 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.41 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -100.2 -0.18 39.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.395 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.489 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 1.5 t80 -63.34 -48.64 77.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.108 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.439 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 8.6 mt-10 -62.58 -58.1 18.76 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.949 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.8 Cg_endo -56.01 -15.54 14.01 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 121.859 1.706 . . . . 0.0 110.955 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.611 HD22 HG13 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -79.12 -38.81 35.24 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.593 179.293 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 24' ' ' PHE . 7.4 mt -82.18 -22.17 36.14 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.383 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.13 -31.96 69.41 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.512 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.458 ' OG ' HG21 ' A' ' 38' ' ' ILE . 1.5 t -66.18 -26.52 67.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.638 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.561 ' HA ' ' HD2' ' A' ' 39' ' ' ARG . 76.4 mt -56.35 -17.74 8.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.864 -179.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.2 m -90.7 21.73 3.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.612 0.244 . . . . 0.0 111.491 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -114.27 123.37 49.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.988 0.423 . . . . 0.0 111.313 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -67.88 -5.6 17.55 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.375 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -75.89 155.85 34.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 0.0 110.947 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.3 p-90 -89.79 -35.0 15.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.068 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -69.35 -33.24 72.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.901 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.458 HG21 ' OG ' ' A' ' 30' ' ' SER . 40.5 mm -82.11 -55.01 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.876 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.561 ' HD2' ' HA ' ' A' ' 31' ' ' LEU . 8.2 tpt180 -57.25 -40.37 77.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.053 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.27 -58.62 10.04 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.931 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.97 -27.31 0.88 Allowed 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.05 -56.78 9.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.843 0.354 . . . . 0.0 111.196 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.544 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -66.41 -37.22 84.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.953 0.406 . . . . 0.0 111.008 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -55.77 -33.4 64.31 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.723 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.3 mm -98.75 -20.45 5.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.187 0.518 . . . . 0.0 110.849 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.611 HG13 HD22 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -60.74 -41.38 88.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.754 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.483 ' HA3' HE21 ' A' ' 79' ' ' GLN . . . -59.75 -16.08 36.75 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.716 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -70.73 -43.34 69.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.474 0.178 . . . . 0.0 111.227 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -92.82 105.7 17.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.78 0.324 . . . . 0.0 110.631 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.514 ' HG3' ' HA ' ' A' ' 80' ' ' ILE . 23.7 mp0 -71.82 74.37 0.86 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.524 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -127.82 155.49 44.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.161 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -64.92 -29.13 70.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.424 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.401 ' HG2' HD13 ' A' ' 28' ' ' LEU . 33.4 ttm180 -69.26 -10.43 57.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.337 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.584 ' HB1' HG22 ' A' ' 46' ' ' ILE . . . -105.97 12.97 29.94 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.882 0.372 . . . . 0.0 111.009 -179.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 53.2 t -86.63 -50.11 14.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.009 -0.542 . . . . 0.0 112.182 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.48 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 42.1 tt0 -55.08 -48.43 96.11 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.48 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 94.5 Cg_exo -45.47 -33.77 9.8 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.426 2.084 . . . . 0.0 112.987 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.7 mt -75.17 -40.77 59.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.829 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.495 HD13 ' HA ' ' A' ' 88' ' ' ALA . 41.0 mm -54.78 -52.96 37.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.16 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -70.09 -22.33 63.05 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.494 ' HG ' HG13 ' A' ' 69' ' ' VAL . 3.0 mp -89.42 -40.13 12.93 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.513 HD13 HD22 ' A' ' 92' ' ' LEU . 13.3 mt -62.2 -10.88 11.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.349 0.595 . . . . 0.0 110.346 -179.238 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -90.67 -39.86 12.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.98 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.463 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 34.5 m-20 -56.52 -179.8 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.76 -178.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -153.33 29.7 0.49 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.762 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.422 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 53.3 m -83.66 -3.41 57.72 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.285 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.49 -98.75 2.41 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.392 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -48.69 -32.72 8.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.235 0.54 . . . . 0.0 110.012 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.494 HG13 ' HG ' ' A' ' 61' ' ' LEU . 60.1 t -72.8 -56.78 8.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.104 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 7.3 tmm_? -65.2 -63.66 1.05 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.339 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 97.3 p -52.05 -22.84 4.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.293 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.16 -43.65 98.33 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.594 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.606 ' HA ' ' HG ' ' A' ' 76' ' ' SER . . . -75.32 -36.84 61.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.573 0.225 . . . . 0.0 111.377 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.22 -40.47 64.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.526 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.3 ptp180 -84.45 -16.58 42.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.489 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.606 ' HG ' ' HA ' ' A' ' 73' ' ' ALA . 54.9 m -65.91 -45.05 83.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.792 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.541 ' HA ' HG23 ' A' ' 85' ' ' VAL . 5.0 mp -55.8 -59.4 4.93 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.454 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -53.74 -29.46 39.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.804 -0.18 . . . . 0.0 111.099 179.716 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.483 HE21 ' HA3' ' A' ' 47' ' ' GLY . 21.0 mt-30 -70.6 -31.99 69.18 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 121.018 0.437 . . . . 0.0 110.346 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.514 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 95.2 mt -80.43 -60.71 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.173 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.76 113.38 0.01 OUTLIER Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.978 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.91 164.1 12.0 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.633 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -64.03 -26.37 68.53 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.805 0.336 . . . . 0.0 110.837 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.568 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -65.95 -53.49 38.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.764 179.894 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.568 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 12.3 p -70.8 -24.77 25.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.389 0.614 . . . . 0.0 110.263 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.429 ' O ' ' HG3' ' A' ' 89' ' ' MET . 17.0 ttp180 -55.88 -20.87 17.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.72 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.02 -34.07 64.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.364 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.495 ' HA ' HD13 ' A' ' 59' ' ' ILE . . . -60.0 -48.58 81.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.851 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.532 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.23 -31.75 69.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.375 179.739 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.35 -36.51 83.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.164 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -79.94 -28.11 39.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.121 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.513 HD22 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -82.48 -24.03 34.42 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.78 -12.49 61.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.738 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -95.86 -14.87 22.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.914 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.0 p -135.12 16.99 3.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.598 0.713 . . . . 0.0 109.199 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -61.5 148.19 47.22 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 114.734 -1.121 . . . . 0.0 113.226 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.412 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 4.3 t -151.25 130.35 12.65 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.79 -0.705 . . . . 0.0 111.001 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.03 -130.11 50.53 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.976 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -60.42 -47.54 85.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.635 0.255 . . . . 0.0 111.389 -179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.422 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -50.17 -41.5 49.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.51 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.412 ' HB2' ' N ' ' A' ' 97' ' ' THR . 9.3 tpt180 -61.52 -61.68 2.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.384 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -53.3 -27.69 24.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.119 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.407 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 13.5 t -63.97 -45.79 95.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.954 -179.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.532 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -62.56 -58.95 5.74 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.474 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 7.3 p -64.43 -52.84 50.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.421 ' N ' HG12 ' A' ' 105' ' ' VAL . 27.1 t-20 -55.78 -32.49 63.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.646 0.26 . . . . 0.0 111.616 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -60.32 -29.24 68.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.058 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 14.1 mt -51.44 -22.36 2.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.65 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.74 3.69 3.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.268 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 53.7 m -105.37 -60.36 1.63 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.788 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.41 ' HD2' ' HD3' ' A' ' 86' ' ' ARG . 82.9 t60 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.638 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ttt . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.808 0.337 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.25 -16.27 38.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.157 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -86.13 -32.26 21.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.142 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -82.99 -10.28 58.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.949 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -158.38 127.68 5.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.883 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -127.33 -27.61 2.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.698 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 3.3 p-90 -152.02 122.23 7.2 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.874 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.607 HG21 ' HA ' ' A' ' 22' ' ' GLU . 2.4 p -128.62 -44.24 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.366 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 -109.25 -16.88 13.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.093 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.454 ' C ' ' H ' ' A' ' 12' ' ' VAL . 33.6 ttp180 -53.51 113.39 1.15 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 28.7 t70 75.01 -18.46 0.44 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.264 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.454 ' H ' ' C ' ' A' ' 10' ' ' ARG . 54.4 t -85.56 125.41 40.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.019 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 41.4 t -162.25 -21.48 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.544 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.5 m -144.57 8.78 1.35 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.233 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.0 -1.94 58.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.516 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.56 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 1.4 pt? -53.01 -13.84 0.51 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.476 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.5 t -54.68 -36.61 64.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.208 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -171.87 80.79 0.06 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.883 0.373 . . . . 0.0 111.747 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.568 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 20.7 mmt -133.94 -43.6 0.8 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.777 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.44 ' HA2' ' HZ ' ' A' ' 49' ' ' PHE . . . 76.35 144.89 1.62 Allowed Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.905 -0.665 . . . . 0.0 113.277 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 16.8 t70 62.38 -79.92 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 122.619 0.368 . . . . 0.0 111.763 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.607 ' HA ' HG21 ' A' ' 8' ' ' VAL . 12.8 pt-20 -62.72 -11.82 19.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.068 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.568 ' HB2' ' HB2' ' A' ' 19' ' ' MET . . . -100.94 -6.22 24.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.666 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.47 -49.42 77.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.999 0.428 . . . . 0.0 110.805 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.412 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 10.8 mt-10 -63.42 -58.92 13.43 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.438 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.418 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 15.0 Cg_endo -56.46 -14.38 12.6 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 121.87 1.714 . . . . 0.0 111.062 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.534 HD12 HG12 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -82.9 -39.0 22.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.535 178.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.453 HD12 HD13 ' A' ' 31' ' ' LEU . 8.7 tp -85.86 -21.38 28.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.325 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -75.81 -37.56 58.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.708 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 60.9 p -65.3 -23.99 67.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.27 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.453 HD13 HD12 ' A' ' 28' ' ' LEU . 86.2 mt -59.2 -7.26 1.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.673 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.5 p -89.92 19.62 4.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.21 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.541 HD22 ' HG3' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -88.19 147.76 24.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.138 0.494 . . . . 0.0 111.432 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.84 -25.74 65.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.622 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.1 162.32 28.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.968 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -110.12 -26.05 9.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.95 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 37' ' ' ARG . 23.4 ttt180 -58.9 -48.16 82.42 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.742 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.4 mm -56.44 -49.85 75.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.339 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.541 ' HG3' HD22 ' A' ' 33' ' ' ASN . 77.8 mtt180 -52.81 -23.84 7.73 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.598 178.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -60.78 -66.59 2.6 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.484 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.3 -42.33 69.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.778 0.323 . . . . 0.0 111.224 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.449 ' HB3' HD11 ' A' ' 27' ' ' LEU . . . -58.02 -54.9 41.73 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.676 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.82 -34.72 74.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.6 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -68.7 -28.07 66.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.773 -179.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.2 mm -91.41 -21.6 6.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.927 0.394 . . . . 0.0 110.54 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.608 HG23 ' HB3' ' A' ' 54' ' ' ALA . 2.4 mm -55.78 -35.16 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.251 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.91 -28.26 63.19 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.869 -0.681 . . . . 0.0 113.022 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.696 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.6 OUTLIER -55.4 -51.44 66.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.9 0.381 . . . . 0.0 110.255 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.44 ' HZ ' ' HA2' ' A' ' 20' ' ' GLY . 37.2 m-85 -83.98 115.58 22.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.741 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.68 25.4 0.78 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.132 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.435 ' O ' HG21 ' A' ' 55' ' ' VAL . 6.2 m-20 -84.0 162.45 20.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.376 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.429 ' HA ' HG21 ' A' ' 55' ' ' VAL . 0.2 OUTLIER -61.58 -37.06 82.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.589 -179.551 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.6 ttp180 -64.45 -11.32 32.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.986 0.422 . . . . 0.0 110.367 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.608 ' HB3' HG23 ' A' ' 46' ' ' ILE . . . -106.02 -10.99 16.3 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.709 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 51' ' ' ASP . 93.6 t -79.05 -44.51 24.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.654 -179.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.546 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -57.69 -51.06 84.51 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.496 -179.564 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.546 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.0 Cg_exo -45.29 -51.67 7.52 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.296 1.997 . . . . 0.0 112.252 179.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.526 HD22 ' HA ' ' A' ' 73' ' ' ALA . 16.7 mt -60.63 -35.57 76.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.484 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 55' ' ' VAL . 42.6 mm -62.78 -59.75 3.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.703 0.287 . . . . 0.0 111.585 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -4.97 23.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.693 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.632 ' HG ' HG11 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -89.59 -44.44 10.08 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -179.353 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.595 HD13 HD12 ' A' ' 77' ' ' LEU . 5.1 mt -56.74 -15.81 5.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.887 0.375 . . . . 0.0 111.4 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -110.85 -9.33 14.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.501 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -61.06 -33.43 73.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.108 0.48 . . . . 0.0 111.212 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.582 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 16.5 t70 54.84 28.98 11.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.688 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.467 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 37.8 t -85.33 -10.94 55.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.636 0.255 . . . . 0.0 111.404 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 96.09 -84.33 0.85 Allowed Glycine 0 C--O 1.228 -0.26 0 C-N-CA 120.712 -0.756 . . . . 0.0 111.97 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.66 -41.52 98.2 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.632 HG11 ' HG ' ' A' ' 61' ' ' LEU . 5.2 t -71.97 -43.46 67.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.133 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.582 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 8.3 ttt180 -69.52 -63.36 1.09 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.703 0.287 . . . . 0.0 111.027 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.9 m -52.49 -23.06 5.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.821 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -66.9 -37.43 92.19 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.147 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.526 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -69.72 -47.47 62.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.649 0.261 . . . . 0.0 111.003 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.23 -26.2 62.58 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.214 0.531 . . . . 0.0 110.002 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.9 ttt180 -82.93 -40.45 20.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.449 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.593 ' HA ' HE21 ' A' ' 79' ' ' GLN . 69.8 m -66.94 -33.24 75.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.676 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.595 HD12 HD13 ' A' ' 62' ' ' LEU . 96.8 mt -65.36 -59.72 3.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.675 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.411 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 36.8 tt0 -51.57 -23.09 3.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.161 0.505 . . . . 0.0 110.032 178.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.593 HE21 ' HA ' ' A' ' 76' ' ' SER . 1.1 tt0 -68.02 -48.14 66.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.985 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 82.2 mt -58.21 -60.22 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.713 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 61.13 107.16 0.01 OUTLIER Glycine 0 C--N 1.332 0.356 0 C-N-CA 121.092 -0.575 . . . . 0.0 113.07 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 155.33 -175.47 33.26 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.621 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -71.34 -26.81 62.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.842 0.353 . . . . 0.0 110.737 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.601 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -68.68 -49.71 56.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 -179.746 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.601 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 11.4 p -70.83 -26.93 28.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.276 0.56 . . . . 0.0 110.798 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.414 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 54.7 ttt180 -58.78 -24.59 62.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.532 -179.157 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.94 -29.0 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.93 0.395 . . . . 0.0 110.701 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.73 -37.68 88.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.71 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.568 ' HE2' ' HA ' ' A' ' 104' ' ' ALA . 6.7 mmm -66.76 -44.38 81.55 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 12.3 mm-40 -57.42 -38.63 74.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.146 178.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -74.49 -29.49 61.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.547 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.496 HD23 HD22 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -87.25 -23.48 24.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.005 0.431 . . . . 0.0 110.296 179.48 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.84 -29.16 69.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.422 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.521 ' HG3' HG23 ' A' ' 95' ' ' THR . 11.2 pt-20 -80.17 -18.13 50.53 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.245 0.545 . . . . 0.0 109.779 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.521 HG23 ' HG3' ' A' ' 94' ' ' GLU . 72.0 p -121.93 21.91 10.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.935 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.441 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -60.64 123.12 31.9 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 114.843 -1.071 . . . . 0.0 113.687 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.3 t -147.76 130.06 15.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.809 0.337 . . . . 0.0 110.786 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.7 -132.77 20.42 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.158 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -77.86 -30.89 51.13 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.658 0.266 . . . . 0.0 111.321 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.472 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -55.27 -37.92 67.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.468 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.441 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 44.5 ttt180 -67.41 -59.02 3.73 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.667 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.2 tppt? -47.33 -21.69 0.33 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.961 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.448 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 18.7 t -75.4 -56.98 7.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.92 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.568 ' HA ' ' HE2' ' A' ' 89' ' ' MET . . . -51.31 -57.6 8.44 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 113.502 0.926 . . . . 0.0 113.502 -178.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.8 t -58.35 -63.6 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -176.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -59.03 -35.2 72.91 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.519 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 42.9 t80 -63.29 -25.76 68.46 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-O 120.829 0.347 . . . . 0.0 111.116 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 96.8 mt -56.59 -20.79 22.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.882 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -62.65 -12.35 22.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.977 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.4 p -132.05 20.01 4.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.315 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 65.6 m80 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.065 179.59 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.6 ptm . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.846 0.355 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -167.33 103.28 0.52 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.174 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 61.11 10.33 2.86 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.43 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -89.08 -55.43 3.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.835 0.35 . . . . 0.0 110.816 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -100.77 93.61 5.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -67.61 -70.07 0.28 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.838 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 40.8 m95 -72.28 87.45 1.13 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.485 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.46 HG11 ' HG2' ' A' ' 9' ' ' ARG . 12.6 p -123.69 -27.0 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.284 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.46 ' HG2' HG11 ' A' ' 8' ' ' VAL . 8.4 ptp180 -145.54 -27.52 0.45 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.191 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.605 ' HE ' ' HA ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -58.87 137.61 57.71 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.967 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 9.3 m-20 68.38 2.9 3.5 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 123.341 0.4 . . . . 0.0 111.428 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 46.5 t -112.29 129.32 68.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.006 0.431 . . . . 0.0 111.54 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 41.1 t -161.65 -66.14 0.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.406 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 39.0 p -101.39 11.95 38.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.701 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.07 -1.76 57.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.15 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.408 ' HA ' ' HB1' ' A' ' 23' ' ' ALA . 2.6 pt? -51.15 -16.56 0.5 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.678 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.6 t -50.57 -40.38 52.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.031 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -175.47 94.87 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.346 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 12.8 mmt -133.66 -43.19 0.83 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.091 179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 121.73 -102.23 0.8 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.622 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 24' ' ' PHE . 3.1 p-10 -102.93 -26.98 12.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.877 0.37 . . . . 0.0 111.256 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -62.23 -32.15 72.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.46 -179.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.442 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.17 0.68 27.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.611 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.515 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 2.7 t80 -63.47 -48.84 76.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.819 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.493 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.3 -50.39 74.82 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -179.207 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.493 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 87.6 Cg_exo -41.93 -24.46 0.3 Allowed 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 122.204 1.936 . . . . 0.0 111.719 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 47.1 mt -76.06 -53.02 8.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.133 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.542 HD11 HD11 ' A' ' 31' ' ' LEU . 24.6 tp -66.98 -24.16 66.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.889 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -76.27 -42.71 44.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.558 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 52.3 m -66.43 -11.18 50.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.981 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.596 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 38.7 mt -67.17 -10.11 46.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.102 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.7 t -100.21 14.36 31.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.511 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -68.91 150.08 48.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.83 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -63.09 -39.4 94.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.038 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -76.12 156.75 33.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.797 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 7.5 m0 -99.93 -33.03 10.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.644 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -64.94 -46.72 80.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.864 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.3 mt -60.4 -39.27 80.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.603 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.596 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 39.0 ttm180 -63.78 -20.75 66.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.335 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.08 -57.56 11.61 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.778 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.66 -36.44 4.87 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.447 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -67.21 -50.86 59.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.91 0.386 . . . . 0.0 110.69 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.05 -32.77 74.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.989 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -70.8 -33.92 71.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.49 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.0 mt -99.21 -19.36 5.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.447 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 5.6 tt -59.31 -38.03 72.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -178.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.431 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -76.14 -14.01 82.69 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.512 -0.851 . . . . 0.0 112.505 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.629 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.8 OUTLIER -70.69 -15.46 62.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.558 0.218 . . . . 0.0 111.148 -179.697 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -83.02 -22.77 33.5 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.322 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 59.94 24.97 14.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.216 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -93.45 163.36 13.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.152 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.425 ' O ' HG22 ' A' ' 55' ' ' VAL . 13.4 tp10 -66.08 -35.37 80.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.98 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.8 ttm180 -64.3 -10.03 21.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.317 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.414 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -101.96 18.63 20.18 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.425 HG22 ' O ' ' A' ' 52' ' ' GLU . 20.4 m -91.8 -46.35 14.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.454 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 4.6 tp10 -59.8 -49.45 91.56 Favored Pre-proline 0 CA--C 1.531 0.216 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.0 Cg_exo -45.16 -53.08 5.7 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.993 1.795 . . . . 0.0 111.895 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.429 HD11 HD11 ' A' ' 77' ' ' LEU . 7.8 mt -57.61 -36.81 72.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.13 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 74.9 mt -63.47 -59.53 4.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.424 ' HG3' HD12 ' A' ' 61' ' ' LEU . 13.6 pttm -66.28 -37.64 85.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.795 0.331 . . . . 0.0 111.631 -178.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.704 ' HG ' HG11 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -54.48 -51.82 63.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.923 -179.456 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.481 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 75.1 mt -58.35 -15.85 12.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.876 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.04 -22.94 15.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.586 179.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -61.34 -36.17 79.44 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.089 0.471 . . . . 0.0 111.302 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.533 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 20.3 t70 57.44 28.06 14.87 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.019 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.479 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 8.0 t -73.35 -11.86 60.63 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.747 0.308 . . . . 0.0 111.116 -179.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.34 -79.01 0.51 Allowed Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.08 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.96 -39.27 69.47 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.704 HG11 ' HG ' ' A' ' 61' ' ' LEU . 17.5 t -71.79 -41.49 70.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.84 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.533 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 6.2 tmm_? -67.73 -58.54 4.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.179 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.0 m -57.75 -35.13 70.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.7 -179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -55.75 -30.29 56.23 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.72 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.28 -52.02 15.47 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -45.98 -47.41 16.66 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -70.13 -30.13 67.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.604 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.607 ' HA ' HE21 ' A' ' 79' ' ' GLN . 50.3 m -65.22 -38.64 91.04 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.429 HD11 HD11 ' A' ' 58' ' ' LEU . 8.2 mp -55.56 -59.36 4.94 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.775 0.321 . . . . 0.0 111.026 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.498 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 41.7 mt-10 -55.46 -35.96 66.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.974 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.607 HE21 ' HA ' ' A' ' 76' ' ' SER . 22.1 mt-30 -61.99 -23.63 66.54 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.559 HG23 ' HD2' ' A' ' 84' ' ' ARG . 39.8 mt -90.22 -61.72 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.444 ' N ' ' NH1' ' A' ' 84' ' ' ARG . . . 64.33 125.62 0.01 OUTLIER Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.962 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.458 ' O ' ' NH2' ' A' ' 84' ' ' ARG . . . 141.97 -169.95 25.1 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.611 -0.804 . . . . 0.0 113.149 179.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -72.91 -22.51 60.73 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.757 ' NE ' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.27 -65.38 0.68 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.187 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.757 ' H ' ' NE ' ' A' ' 84' ' ' ARG . 47.8 t -70.8 -20.52 22.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.08 0.467 . . . . 0.0 109.822 178.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.548 ' HA ' ' HE1' ' A' ' 89' ' ' MET . 2.2 tmm_? -46.25 -36.25 5.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.207 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -86.22 -27.86 24.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.705 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.19 -49.57 69.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.902 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.548 ' HE1' ' HA ' ' A' ' 86' ' ' ARG . 9.3 ptt? -58.73 -41.56 86.72 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.84 0.352 . . . . 0.0 110.294 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -63.2 -29.97 71.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.026 0.441 . . . . 0.0 109.855 178.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.438 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 10.8 tmtt? -71.06 -42.17 69.77 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.562 179.082 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.531 HD21 ' HB2' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -74.8 -24.47 58.65 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.543 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.16 -27.68 64.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.46 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -81.57 -26.58 34.85 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.619 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 74.1 p -109.67 20.91 17.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.352 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -55.41 115.59 5.96 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.027 -0.988 . . . . 0.0 113.441 -178.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.6 m -140.0 129.91 24.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.719 0.295 . . . . 0.0 110.697 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.18 -141.92 46.97 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.812 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -63.83 -25.28 68.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 111.202 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.556 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -55.63 -44.07 76.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.815 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.463 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 34.3 ttp180 -64.07 -53.77 44.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.704 0.288 . . . . 0.0 111.412 -179.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.6 tptp -50.28 -22.04 1.62 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.887 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.556 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 4.8 t -73.16 -57.58 6.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.901 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.531 ' HB2' HD21 ' A' ' 92' ' ' LEU . . . -57.32 -52.66 64.44 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 51.1 t -60.7 -45.87 96.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.504 ' N ' HD21 ' A' ' 106' ' ' ASN . 0.9 OUTLIER -70.75 -39.03 73.53 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.166 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.743 ' HH ' HH22 ' A' ' 84' ' ' ARG . 41.2 t80 -63.51 -23.92 67.59 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.163 0.506 . . . . 0.0 111.024 -178.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.519 ' HG ' ' HE3' ' A' ' 89' ' ' MET . 0.5 OUTLIER -49.98 -30.87 11.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.88 179.516 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.537 ' HG3' HG22 ' A' ' 110' ' ' THR . 12.1 pt-20 -65.12 -8.89 18.79 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' THR . . . . . 0.537 HG22 ' HG3' ' A' ' 109' ' ' GLU . 62.9 p -130.44 19.12 5.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.618 0.247 . . . . 0.0 111.42 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.2 m80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.994 179.866 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.8 mmm . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.835 0.35 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.43 -52.48 4.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.143 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -143.47 105.98 4.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.056 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -154.98 -60.67 0.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.649 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.426 HD21 HG21 ' A' ' 8' ' ' VAL . 0.6 OUTLIER -71.1 106.15 3.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.568 179.634 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -168.79 -0.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.992 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -131.72 10.16 4.68 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.325 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.502 HG22 ' HB2' ' A' ' 21' ' ' ASP . 31.5 m -90.44 44.27 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.218 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.445 ' HD3' ' HA2' ' A' ' 20' ' ' GLY . 33.2 ptt180 -159.5 -9.94 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.505 -179.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -53.94 105.26 0.13 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.356 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.4 t70 71.6 43.37 0.59 Allowed 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.291 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.48 ' O ' ' HB2' ' A' ' 17' ' ' SER . 38.3 t -141.01 109.87 2.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.333 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.457 ' HB3' HG22 ' A' ' 45' ' ' ILE . 9.7 p 64.55 -173.67 0.17 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.96 179.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.7 p -119.59 -76.17 0.58 Allowed 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.277 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.76 77.49 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.185 0.517 . . . . 0.0 110.555 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.654 HD11 ' HB2' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -79.28 -13.53 59.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.381 -179.559 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.48 ' HB2' ' O ' ' A' ' 12' ' ' VAL . 10.8 t -86.93 -5.56 59.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.186 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 18' ' ' ARG . 29.8 ttp180 -102.43 3.59 37.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.525 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.669 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 14.7 mmt -125.81 -41.38 1.98 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.763 0.315 . . . . 0.0 110.924 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.445 ' HA2' ' HD3' ' A' ' 9' ' ' ARG . . . 110.49 -144.82 17.18 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.754 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.502 ' HB2' HG22 ' A' ' 8' ' ' VAL . 23.4 t70 -63.54 -26.88 68.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.744 0.306 . . . . 0.0 110.605 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.63 -18.19 65.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.222 0.534 . . . . 0.0 110.148 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.669 ' HB2' ' HB2' ' A' ' 19' ' ' MET . . . -83.9 -12.49 55.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.132 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.505 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -59.38 -50.62 73.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.652 -179.604 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.431 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -57.56 -57.36 25.83 Favored Pre-proline 0 C--N 1.325 -0.5 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.185 -179.935 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 1.1 Cg_endo -49.95 -26.39 14.12 Favored 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 121.944 1.763 . . . . 0.0 111.099 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.654 ' HB2' HD11 ' A' ' 16' ' ' LEU . 0.4 OUTLIER -73.75 -41.93 61.8 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.104 178.94 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.551 HD12 HD13 ' A' ' 31' ' ' LEU . 7.2 tp -76.84 -17.97 58.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.155 -0.93 . . . . 0.0 109.492 178.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -70.65 -32.36 69.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.619 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.3 t -65.93 -27.09 67.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.188 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.59 HD22 ' HG3' ' A' ' 39' ' ' ARG . 69.8 mt -66.52 -9.91 39.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.859 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 43.3 t -93.88 16.89 13.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.1 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -100.58 139.42 36.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.931 0.396 . . . . 0.0 111.144 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.69 -16.95 64.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.328 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -78.9 127.51 32.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.845 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -82.41 -27.39 32.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.132 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -62.96 -48.09 80.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.856 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 62.0 mt -73.07 -44.36 56.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.015 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.59 ' HG3' HD22 ' A' ' 31' ' ' LEU . 42.8 ttp180 -59.51 -27.5 66.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.821 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.83 -58.43 14.63 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.499 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.52 -42.72 67.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.673 0.273 . . . . 0.0 111.519 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.419 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.97 -56.16 24.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.856 0.36 . . . . 0.0 111.059 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.19 -31.4 71.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.256 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -69.93 -34.93 74.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.694 -0.684 . . . . 0.0 112.736 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.503 ' HA ' HD21 ' A' ' 48' ' ' ASN . 26.1 mm -98.93 -19.47 5.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.858 0.361 . . . . 0.0 111.843 -178.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.62 ' HA ' HD21 ' A' ' 27' ' ' LEU . 5.8 tt -57.23 -36.63 52.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.932 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.58 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -76.69 -12.55 84.36 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.457 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.503 HD21 ' HA ' ' A' ' 45' ' ' ILE . 21.4 m-80 -68.77 -21.17 64.37 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -83.85 -36.22 23.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.62 0.248 . . . . 0.0 111.249 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.533 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.8 OUTLIER 68.38 55.81 0.5 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.123 179.735 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.429 ' O ' HG21 ' A' ' 55' ' ' VAL . 7.5 m-20 -127.79 -178.28 4.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.02 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.36 -38.44 91.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.954 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -65.7 -12.08 50.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.052 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.9 7.51 32.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.051 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.429 HG21 ' O ' ' A' ' 51' ' ' ASP . 86.1 t -91.37 -59.28 3.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.412 -178.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.422 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 22.5 tt0 -60.09 -49.4 91.17 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.422 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 83.1 Cg_exo -42.56 -52.78 4.2 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.334 2.023 . . . . 0.0 112.86 -179.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.508 HD22 ' HA ' ' A' ' 73' ' ' ALA . 12.0 mt -59.81 -34.76 73.47 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.741 -179.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.4 HG12 ' O ' ' A' ' 55' ' ' VAL . 51.3 mm -63.44 -59.89 3.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.83 -6.37 37.44 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.622 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -89.42 -37.13 15.04 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.478 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.611 HD13 HD21 ' A' ' 92' ' ' LEU . 5.9 mt -62.97 -9.64 10.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.492 . . . . 0.0 110.651 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -112.48 -12.61 13.47 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.995 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.42 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.0 t0 -61.03 -30.05 70.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.256 0.55 . . . . 0.0 110.668 179.659 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.442 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 38.5 m-20 48.58 30.62 2.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.698 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.49 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 18.4 t -83.82 -5.66 59.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.717 0.294 . . . . 0.0 111.118 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.12 -80.55 1.2 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.279 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -67.52 -43.8 79.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.123 0.487 . . . . 0.0 109.824 179.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.622 HG12 ' HG ' ' A' ' 61' ' ' LEU . 42.3 t -73.45 -38.53 53.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.576 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.442 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 4.8 tmm_? -72.55 -62.62 1.38 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.09 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.2 t -51.99 -27.76 14.55 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.865 0.364 . . . . 0.0 110.813 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.49 -45.76 95.02 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.097 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.508 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -59.89 -45.26 93.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.945 0.402 . . . . 0.0 110.49 179.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.84 -24.68 67.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.571 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 ttt85 -83.64 -39.01 20.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.333 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.58 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 51.5 m -66.66 -35.82 81.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.01 -179.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 73' ' ' ALA . 77.7 mt -55.5 -60.12 3.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.737 0.303 . . . . 0.0 111.226 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -53.98 -29.38 42.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.952 0.406 . . . . 0.0 110.289 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.433 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 48.1 mt-30 -70.41 -38.76 74.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.292 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.533 HG12 ' HG3' ' A' ' 50' ' ' GLN . 67.8 mt -75.89 -61.08 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.149 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.472 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 57.99 110.64 0.01 OUTLIER Glycine 0 C--N 1.332 0.312 0 C-N-CA 121.154 -0.546 . . . . 0.0 113.207 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.95 -171.36 37.0 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.769 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -62.56 -40.35 96.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.844 0.354 . . . . 0.0 110.632 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.412 ' HD2' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -58.48 -43.81 89.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.448 179.81 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.472 HG21 ' N ' ' A' ' 81' ' ' GLY . 2.2 t -70.94 -27.58 30.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.589 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -31.44 62.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.804 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.52 -19.62 30.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.818 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.87 -50.94 53.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.572 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -28.64 63.35 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.815 0.341 . . . . 0.0 110.883 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -69.59 -33.03 72.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.801 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -80.66 -25.4 38.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.088 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.611 HD21 HD13 ' A' ' 62' ' ' LEU . 3.9 tp -86.71 -31.27 21.1 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.93 -26.48 62.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.713 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -79.97 -29.1 39.52 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 36.3 p -110.59 25.88 11.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.982 178.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.508 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -47.14 108.64 0.31 Allowed Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.62 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.5 p -142.7 130.51 21.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.924 0.393 . . . . 0.0 111.241 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.58 -141.37 47.72 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.084 -0.579 . . . . 0.0 113.349 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -68.35 -27.26 66.1 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 122.465 0.306 . . . . 0.0 111.68 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.584 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -54.52 -47.71 72.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.878 0.37 . . . . 0.0 111.738 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.508 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 45.9 ttp180 -56.41 -59.97 4.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.802 -179.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -45.57 -25.76 0.5 Allowed 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.953 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.584 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 52.6 t -74.68 -56.51 8.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.608 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.596 ' HB1' HD23 ' A' ' 92' ' ' LEU . . . -53.84 -47.25 71.14 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.512 ' HA ' HD13 ' A' ' 108' ' ' LEU . 48.8 t -65.48 -55.52 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -62.72 -43.74 98.03 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.407 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 31.0 t80 -60.51 -27.56 67.7 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 120.889 0.376 . . . . 0.0 111.527 -178.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.512 HD13 ' HA ' ' A' ' 105' ' ' VAL . 9.9 mt -56.58 -21.51 27.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.537 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -77.06 4.43 10.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.582 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 5.2 m -111.38 -75.76 0.61 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.749 0.309 . . . . 0.0 111.051 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.819 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.5 mtt . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.843 0.354 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.26 21.61 8.36 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.446 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -152.01 136.46 16.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.874 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 59.09 14.06 3.26 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.973 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -142.51 -45.49 0.32 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.859 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt 63.27 -79.15 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.811 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 2.2 p-90 -134.26 115.94 14.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.15 0.5 . . . . 0.0 110.797 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.463 HG21 ' HG3' ' A' ' 9' ' ' ARG . 30.5 m -133.96 -33.36 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.299 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.546 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -164.55 -1.44 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.715 179.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.5 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 48.4 ttp180 -62.77 108.61 1.21 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 178.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 5.9 m-20 70.57 11.67 7.31 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.46 -179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.546 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 55.8 t -86.36 -67.1 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.491 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.413 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 35.1 t 73.23 -27.59 0.19 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.663 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.552 ' HB ' ' HB3' ' A' ' 17' ' ' SER . 79.1 p -80.91 139.5 35.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.677 0.275 . . . . 0.0 110.807 179.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.82 -67.8 0.83 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -86.17 -21.02 27.75 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 -178.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.552 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 25.3 t -64.78 -52.79 55.03 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -178.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 17' ' ' SER . 53.3 ttp180 175.07 111.0 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.731 -179.517 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.517 ' HG2' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -133.47 -38.43 0.93 Allowed 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.623 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.448 ' N ' ' SD ' ' A' ' 19' ' ' MET . . . 152.97 -102.73 0.23 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.342 -0.933 . . . . 0.0 113.031 -179.337 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.451 ' HA ' ' HB2' ' A' ' 24' ' ' PHE . 4.2 p-10 -137.67 -23.46 1.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.669 0.271 . . . . 0.0 111.268 -179.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 23' ' ' ALA . 9.9 pt-20 -61.2 -42.2 98.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.295 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.517 ' HB1' ' HG2' ' A' ' 19' ' ' MET . . . -103.5 16.8 25.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.39 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.513 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.2 t80 -63.34 -46.91 84.43 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.841 0.353 . . . . 0.0 110.316 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' A' ' 27' ' ' LEU . 37.1 mt-10 -43.34 -54.24 10.04 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 53.7 Cg_exo -35.99 -31.05 0.08 OUTLIER 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.515 2.143 . . . . 0.0 112.011 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.513 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 75.2 mt -71.71 -57.55 4.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.132 178.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.475 HD23 HD13 ' A' ' 31' ' ' LEU . 3.4 tm? -55.5 -39.66 70.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.726 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -62.75 -29.37 70.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.336 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 29.1 t -64.53 -20.42 66.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.428 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.597 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 59.5 mt -69.63 -11.74 61.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.805 0.336 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.2 m -101.99 14.61 31.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.004 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -94.05 139.51 30.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.883 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -63.22 -17.9 62.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.8 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -77.2 155.68 32.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.139 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -110.83 -39.31 4.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.667 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -60.03 -34.24 73.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.976 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.1 mt -82.61 -42.98 18.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.265 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.597 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 40.6 ttm180 -58.66 -47.54 84.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.395 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.03 -56.23 26.3 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.687 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.36 -33.76 21.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.772 0.32 . . . . 0.0 111.224 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.81 -47.48 84.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.567 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -76.6 -23.69 53.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.156 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.2 m95 -61.13 -38.39 86.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.011 0.434 . . . . 0.0 110.588 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.0 mm -99.86 -18.71 6.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.267 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.567 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -50.09 -44.61 22.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.17 -178.882 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.419 ' N ' ' CG2' ' A' ' 46' ' ' ILE . . . -72.53 -14.68 77.48 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.617 -0.801 . . . . 0.0 113.04 -179.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -70.69 -10.6 59.78 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.552 0.205 . . . . 0.0 111.552 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -92.75 -26.05 17.92 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.611 ' HG3' HG12 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 62.51 51.03 3.38 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.942 0.401 . . . . 0.0 111.123 -179.849 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -127.17 171.28 11.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.99 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.75 -36.56 83.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.794 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -66.61 -9.61 37.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.771 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.503 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -100.99 3.86 41.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.648 -179.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 47.6 t -92.06 -53.23 9.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.246 -179.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.536 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 12.7 tt0 -60.15 -51.21 81.98 Favored Pre-proline 0 CA--C 1.533 0.289 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -178.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 82.8 Cg_exo -46.58 -37.31 20.08 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.332 2.021 . . . . 0.0 112.649 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.456 HD11 HD12 ' A' ' 77' ' ' LEU . 48.9 mt -65.77 -40.55 92.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.065 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.452 HD13 ' HA ' ' A' ' 88' ' ' ALA . 46.7 mm -52.77 -54.38 16.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.294 -0.412 . . . . 0.0 112.08 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.82 74.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.042 -178.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.683 HD23 ' H ' ' A' ' 73' ' ' ALA . 0.3 OUTLIER -64.52 -37.54 87.91 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.284 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.518 ' HB3' HD22 ' A' ' 92' ' ' LEU . 34.9 mt -59.72 -13.73 11.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.306 0.574 . . . . 0.0 110.104 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -112.51 -13.43 13.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.241 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.471 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.6 OUTLIER -61.25 93.99 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.759 179.639 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -75.04 33.95 0.1 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.083 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.454 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 10.8 t -79.36 -27.11 41.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.972 0.415 . . . . 0.0 110.404 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.74 -110.12 1.13 Allowed Glycine 0 N--CA 1.453 -0.186 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.097 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -54.68 -25.46 27.31 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.535 HG13 ' HG ' ' A' ' 61' ' ' LEU . 41.3 t -64.72 -47.28 89.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.047 178.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -54.58 -54.44 41.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.948 0.404 . . . . 0.0 110.423 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 80.7 p -67.24 -16.59 64.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.071 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.548 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -52.53 -67.55 2.02 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.519 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.683 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -59.24 -36.51 75.6 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.538 0.209 . . . . 0.0 111.173 179.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -45.35 -56.38 5.01 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.574 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 72' ' ' GLY . 0.0 OUTLIER -70.2 -26.73 64.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.144 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.583 ' HA ' HE21 ' A' ' 79' ' ' GLN . 51.8 m -64.77 -39.27 93.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.74 0.305 . . . . 0.0 111.032 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.456 HD12 HD11 ' A' ' 58' ' ' LEU . 4.8 mp -61.08 -60.45 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.873 0.368 . . . . 0.0 110.55 179.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -57.21 -19.93 23.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.636 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.583 HE21 ' HA ' ' A' ' 76' ' ' SER . 3.3 tt0 -68.08 -56.99 6.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.432 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.611 HG12 ' HG3' ' A' ' 50' ' ' GLN . 82.7 mt -64.99 -60.59 2.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.143 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.12 102.37 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.451 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 174.83 -174.6 46.76 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.673 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -68.5 -37.03 79.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.872 0.368 . . . . 0.0 110.88 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.499 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.91 -46.19 90.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.528 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.608 HG22 ' HB ' ' A' ' 80' ' ' ILE . 21.3 t -70.88 -25.14 25.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.147 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -58.42 -35.01 71.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.55 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.33 -21.85 48.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.386 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.452 ' HA ' HD13 ' A' ' 59' ' ' ILE . . . -71.4 -41.86 69.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.287 179.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.492 ' HE1' HD21 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -72.26 -35.0 68.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.136 179.6 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -60.43 -44.88 95.33 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.513 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 3.8 tmtp? -62.34 -32.53 73.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.838 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.518 HD22 ' HB3' ' A' ' 62' ' ' LEU . 0.6 OUTLIER -83.06 -25.48 32.04 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.73 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.01 -18.92 64.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.332 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -80.3 -31.04 38.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.873 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.4 p -115.83 22.13 13.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.56 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.445 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.27 119.09 11.78 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.255 -0.884 . . . . 0.0 113.339 -178.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 26.0 m -143.83 129.11 18.83 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.744 0.306 . . . . 0.0 110.804 178.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.24 -136.34 51.05 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.861 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.417 ' O ' HG23 ' A' ' 103' ' ' VAL . 64.3 t80 -60.86 -38.01 84.1 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.797 0.332 . . . . 0.0 110.711 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.457 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -50.71 -41.59 56.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.879 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.445 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 38.6 ttt180 -68.91 -59.54 2.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.793 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -46.29 -23.97 0.42 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.917 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.448 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.9 t -66.16 -60.31 2.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.276 179.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.48 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -58.48 -52.0 67.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.968 0.413 . . . . 0.0 111.774 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 61.7 t -57.69 -61.72 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.496 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -58.62 -30.06 66.98 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -59.71 -27.05 66.12 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.017 0.437 . . . . 0.0 110.49 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.492 HD21 ' HE1' ' A' ' 89' ' ' MET . 18.2 mt -59.99 -29.3 68.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.448 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -52.45 -25.75 10.91 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.152 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.8 p -101.91 -50.67 3.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.037 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.896 -179.817 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 mpp? . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.762 0.315 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.37 -169.44 1.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.262 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -87.62 -7.08 57.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.722 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -84.43 19.19 1.99 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.782 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -79.58 17.15 0.92 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.177 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -93.68 -14.29 26.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.314 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -91.81 18.86 7.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.721 0.296 . . . . 0.0 111.316 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.1 p -102.93 152.27 5.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.316 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.474 ' H ' ' HB3' ' A' ' 21' ' ' ASP . 13.1 ptp180 43.32 24.94 0.06 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.368 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.45 ' C ' ' H ' ' A' ' 12' ' ' VAL . 20.5 mmm180 -71.56 103.84 3.11 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.6 t70 71.07 -10.32 0.77 Allowed 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.211 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.45 ' H ' ' C ' ' A' ' 10' ' ' ARG . 9.7 t -117.0 157.69 17.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.032 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 55.3 m -156.88 13.11 0.26 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.279 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.63 HG21 ' HA ' ' A' ' 18' ' ' ARG . 88.2 m -150.34 92.52 1.88 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.231 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.6 ' H ' ' H ' ' A' ' 20' ' ' GLY . . . -95.96 -73.07 0.61 Allowed 'General case' 0 C--O 1.232 0.15 0 C-N-CA 120.371 -0.532 . . . . 0.0 111.523 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.8 tt -90.75 -68.63 0.78 Allowed 'General case' 0 C--O 1.231 0.104 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.445 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.472 ' O ' ' HB2' ' A' ' 18' ' ' ARG . 47.5 t -91.89 -53.4 4.29 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.241 178.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.63 ' HA ' HG21 ' A' ' 14' ' ' THR . 66.3 ttt180 171.74 64.08 0.0 OUTLIER 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.752 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.422 ' SD ' ' HB2' ' A' ' 23' ' ' ALA . 8.3 mtp -125.28 -43.68 1.92 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.402 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.6 ' H ' ' H ' ' A' ' 15' ' ' ALA . . . 77.26 100.39 0.17 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.92 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.483 ' H ' ' HB3' ' A' ' 15' ' ' ALA . 15.8 t70 70.56 -21.63 0.19 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 122.606 0.363 . . . . 0.0 111.816 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.501 ' H ' ' C ' ' A' ' 20' ' ' GLY . 27.4 tt0 -85.65 -24.86 26.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.975 0.417 . . . . 0.0 110.405 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.599 ' HB1' ' HB2' ' A' ' 15' ' ' ALA . . . -95.93 9.24 41.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.164 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 3.0 t80 -63.35 -46.45 86.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.925 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.436 ' O ' ' N ' ' A' ' 27' ' ' LEU . 6.4 mm-40 -63.4 -51.95 64.1 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.675 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.505 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 95.8 Cg_exo -42.93 -19.12 0.12 Allowed 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 122.427 2.085 . . . . 0.0 111.926 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.2 mt -85.66 -52.39 5.83 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.159 178.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.483 HD12 HD13 ' A' ' 31' ' ' LEU . 52.5 tp -59.29 -33.65 71.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.728 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.99 -28.42 69.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.843 0.354 . . . . 0.0 110.745 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.8 t -63.69 -21.39 66.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.516 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.618 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 42.0 mt -67.5 -6.74 21.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.696 0.284 . . . . 0.0 111.047 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 91.5 p -113.94 20.45 15.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.318 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.04 150.42 21.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.87 0.367 . . . . 0.0 111.184 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.95 -29.18 69.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.048 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -78.29 160.69 27.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.926 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.9 p90 -111.15 -39.6 4.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.177 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -59.68 -34.65 73.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.933 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.7 mt -76.86 -42.52 33.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.683 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.618 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 27.5 ttm180 -54.16 -32.18 54.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.71 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.4 -47.07 65.19 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.232 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.3 -24.81 12.63 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.759 0.314 . . . . 0.0 111.138 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.406 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -68.58 -57.42 5.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.388 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.82 -17.5 62.15 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.24 0.543 . . . . 0.0 110.582 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -46.79 87.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.183 -179.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.407 ' HA ' HD21 ' A' ' 48' ' ' ASN . 12.6 mt -98.53 -24.32 4.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.406 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 5.1 tt -56.44 -24.59 19.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.685 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.44 -27.43 65.63 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.905 -179.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.407 HD21 ' HA ' ' A' ' 45' ' ' ILE . 43.5 m-80 -59.84 -22.31 62.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.646 0.26 . . . . 0.0 111.471 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -105.07 107.73 18.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.425 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.634 ' HG3' HG21 ' A' ' 80' ' ' ILE . 1.4 mp0 -65.91 78.87 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.139 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -127.61 153.86 45.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.514 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.402 ' O ' HG21 ' A' ' 55' ' ' VAL . 13.5 pt-20 -64.91 -28.44 69.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.443 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -69.33 -12.12 61.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.363 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.421 ' HB3' ' HZ ' ' A' ' 24' ' ' PHE . . . -104.37 21.94 15.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.406 ' CG2' ' N ' ' A' ' 56' ' ' GLU . 32.7 m -91.75 -57.88 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.717 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 28.7 tt0 -60.31 -50.52 85.47 Favored Pre-proline 0 CA--C 1.533 0.319 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.484 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 95.1 Cg_exo -40.37 -52.03 3.15 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.495 2.13 . . . . 0.0 112.99 -179.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' A' ' 62' ' ' LEU . 4.1 mt -62.97 -46.67 86.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.717 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.6 mm -56.82 -56.24 15.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -179.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -70.09 -16.99 63.2 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.686 ' HG ' HG11 ' A' ' 69' ' ' VAL . 11.4 tp -90.47 -40.7 11.86 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -177.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.483 HD11 ' HG3' ' A' ' 63' ' ' GLU . 2.9 pp -64.6 -9.76 21.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.76 0.314 . . . . 0.0 111.657 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.483 ' HG3' HD11 ' A' ' 62' ' ' LEU . 24.0 mt-10 -98.81 -11.87 21.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.553 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.4 ' HB3' ' CG1' ' A' ' 69' ' ' VAL . 7.0 t70 -62.58 -30.64 71.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.175 0.512 . . . . 0.0 111.339 -179.077 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.665 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 12.3 m-20 63.6 23.94 13.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.935 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.8 t -83.68 1.37 42.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.603 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.551 ' H ' ' HG2' ' A' ' 70' ' ' ARG . . . 84.8 -94.17 1.86 Allowed Glycine 0 C--O 1.227 -0.311 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.671 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -49.33 -44.88 44.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.41 0.624 . . . . 0.0 110.066 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.686 HG11 ' HG ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -63.4 -44.76 99.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.076 -0.966 . . . . 0.0 112.271 -178.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.665 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 13.6 ptt180 -78.44 -22.48 47.56 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.426 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 67.6 m -66.85 -52.11 47.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.588 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -52.73 -47.73 57.9 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.013 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.469 ' HA ' ' HG ' ' A' ' 76' ' ' SER . . . -56.56 -39.27 73.17 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.019 0.438 . . . . 0.0 110.882 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.463 ' HA ' HG11 ' A' ' 103' ' ' VAL . . . -61.87 -54.2 45.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.782 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 71' ' ' SER . 6.6 ptp180 -70.99 -27.26 63.57 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.469 ' HG ' ' HA ' ' A' ' 73' ' ' ALA . 32.0 p -63.33 -40.04 96.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.454 0.169 . . . . 0.0 111.449 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 93.1 mt -61.43 -59.83 4.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.719 0.295 . . . . 0.0 110.572 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -55.16 -25.73 34.1 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.095 0.474 . . . . 0.0 110.052 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.407 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 4.3 mt-30 -69.46 -45.0 70.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.223 179.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.634 HG21 ' HG3' ' A' ' 50' ' ' GLN . 90.4 mt -64.16 -61.13 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.712 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.46 124.53 0.01 OUTLIER Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.008 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 150.65 165.17 12.48 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.914 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -58.13 -22.27 50.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.863 0.363 . . . . 0.0 110.76 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.554 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -74.06 -36.67 64.37 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.895 -179.693 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.554 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 13.7 t -70.77 -28.59 34.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.013 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 86' ' ' ARG . 18.1 tpt85 -51.39 -29.52 15.96 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.215 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.12 -31.21 23.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.098 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.47 -56.66 12.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.592 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.573 ' HE2' ' HB1' ' A' ' 104' ' ' ALA . 3.2 ppp? -64.21 -24.87 67.83 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.563 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.433 ' N ' ' SD ' ' A' ' 89' ' ' MET . 6.0 mm-40 -68.8 -31.22 70.07 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.424 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 1.8 tmtp? -71.53 -37.24 71.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.358 179.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.477 HD13 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -82.2 -26.87 32.97 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.63 -26.32 66.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.192 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -80.17 -26.81 39.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.719 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.8 p -109.96 19.24 19.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.576 178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.518 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -52.93 111.71 1.82 Allowed Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.276 -0.874 . . . . 0.0 113.101 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.2 t -142.85 130.85 21.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.838 0.352 . . . . 0.0 110.873 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.44 -126.6 35.89 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.729 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -80.58 -29.84 36.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.882 0.372 . . . . 0.0 110.855 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.459 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -51.57 -34.7 38.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.677 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.518 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 42.4 ttt180 -72.04 -56.68 5.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.738 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -45.95 -23.15 0.26 Allowed 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.769 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.463 HG11 ' HA ' ' A' ' 74' ' ' ALA . 53.9 t -69.92 -57.66 7.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.593 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.573 ' HB1' ' HE2' ' A' ' 89' ' ' MET . . . -59.47 -55.27 36.75 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -178.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.428 HG13 ' N ' ' A' ' 106' ' ' ASN . 7.0 p -62.64 -55.72 22.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.428 ' N ' HG13 ' A' ' 105' ' ' VAL . 27.1 t-20 -56.95 -31.23 64.77 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -178.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.411 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 7.0 t80 -60.4 -33.4 72.43 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.103 0.478 . . . . 0.0 110.635 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -54.38 -13.3 0.87 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.788 -179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -54.2 -20.68 7.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.202 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.6 p -110.82 -69.64 0.86 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.351 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 60.9 m80 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.92 -179.929 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.767 0.318 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.61 -40.76 6.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.996 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.3 177.65 5.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.981 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 58.26 23.08 9.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.946 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -129.96 -170.03 2.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.855 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm 63.64 18.18 10.92 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.486 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 9.3 p-90 -135.36 7.36 3.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.82 0.343 . . . . 0.0 110.931 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.2 p -66.69 -35.7 75.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.197 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 -121.42 -36.1 3.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.989 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.654 ' HE ' ' H ' ' A' ' 11' ' ' ASP . 6.9 tpm_? -64.19 139.44 58.77 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.654 ' H ' ' HE ' ' A' ' 10' ' ' ARG . 16.9 t70 77.78 -28.25 0.17 Allowed 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.504 0.503 . . . . 0.0 111.752 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.405 ' H ' ' C ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -99.18 154.59 4.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.043 0.449 . . . . 0.0 111.826 -179.372 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.3 t -156.88 -40.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.315 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.513 HG23 ' HB3' ' A' ' 17' ' ' SER . 0.9 OUTLIER -64.43 168.47 5.74 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.634 179.334 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.479 ' H ' ' HG1' ' A' ' 14' ' ' THR . . . -95.32 -67.97 0.82 Allowed 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.12 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.41 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.4 pt? -84.91 -39.0 18.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.349 0.499 . . . . 0.0 112.349 -178.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.513 ' HB3' HG23 ' A' ' 14' ' ' THR . 38.9 t -54.89 -51.77 64.97 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.101 -0.24 . . . . 0.0 110.947 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -151.92 114.8 4.65 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.996 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.45 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -128.46 -43.52 1.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.768 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 97.11 74.9 1.21 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.829 -0.7 . . . . 0.0 113.05 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 62.17 8.65 2.76 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -101.12 -44.69 5.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.922 0.391 . . . . 0.0 110.804 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.463 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . -106.44 9.98 31.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.831 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.442 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 3.8 t80 -61.62 -42.15 98.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.016 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -59.4 -54.55 54.94 Favored Pre-proline 0 C--N 1.33 -0.279 0 C-N-CA 120.629 -0.429 . . . . 0.0 111.384 -179.585 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.463 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 52.2 Cg_exo -48.28 -26.39 8.28 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.886 1.724 . . . . 0.0 110.86 178.714 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.463 HD22 HG13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -80.14 -36.41 35.26 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.618 179.472 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.596 HD12 HD13 ' A' ' 31' ' ' LEU . 9.4 tp -76.99 -24.61 52.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.446 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -68.94 -42.66 76.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.897 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.6 m -66.56 -12.87 59.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.569 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.596 HD13 HD12 ' A' ' 28' ' ' LEU . 81.1 mt -68.9 -7.16 32.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.687 0.28 . . . . 0.0 111.252 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.2 p -110.16 8.04 23.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.035 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.491 HD22 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -67.58 150.32 48.95 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.923 -179.839 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -64.12 -31.16 72.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.325 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.27 152.27 36.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.075 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 13.4 p90 -100.61 -33.33 10.35 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.161 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -58.79 -50.91 72.18 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.428 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.447 ' HB ' ' OD1' ' A' ' 33' ' ' ASN . 77.8 mt -63.22 -39.76 86.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.368 179.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.507 ' CZ ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -62.3 -23.47 66.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.158 179.504 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.09 -59.61 4.57 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.032 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.6 -36.17 4.54 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.829 0.347 . . . . 0.0 110.78 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.53 -48.97 79.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.261 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.42 ' HB3' HD21 ' A' ' 61' ' ' LEU . . . -66.19 -30.64 71.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.042 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.0 m95 -68.31 -32.44 72.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.506 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.5 mt -98.93 -19.88 5.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.784 0.326 . . . . 0.0 111.528 -179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.463 HG13 HD22 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -60.35 -40.25 83.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.866 -178.908 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.07 -23.35 78.11 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.639 -0.791 . . . . 0.0 113.078 -179.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -70.75 2.08 4.62 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -101.22 -28.15 12.82 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.539 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.434 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.3 OUTLIER 57.26 31.48 20.17 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.117 0.484 . . . . 0.0 110.897 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -102.55 162.69 12.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.137 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.413 ' HA ' HG21 ' A' ' 55' ' ' VAL . 10.4 pt-20 -61.76 -33.49 74.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 110.574 179.714 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.445 ' NE ' HD22 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -68.24 -16.68 64.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.354 179.721 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -96.75 -5.83 37.66 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.664 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.413 HG21 ' HA ' ' A' ' 52' ' ' GLU . 94.2 t -76.15 -46.29 34.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.535 -179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.514 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 34.6 tt0 -60.37 -50.4 85.97 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.514 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 95.0 Cg_exo -44.15 -53.85 4.38 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.549 2.166 . . . . 0.0 113.016 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.585 HD13 HD21 ' A' ' 77' ' ' LEU . 9.6 mt -54.5 -37.64 65.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.442 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.1 mm -59.67 -61.04 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -70.62 -12.21 61.42 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.608 ' HG ' HG11 ' A' ' 69' ' ' VAL . 1.5 mp -89.39 -41.53 12.06 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -177.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.6 HD12 HD22 ' A' ' 77' ' ' LEU . 12.3 mt -64.49 -9.89 21.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.115 0.483 . . . . 0.0 110.997 -178.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -116.18 -12.11 11.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.703 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.415 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -61.27 -32.91 72.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.346 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.558 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 17.8 m-20 59.13 29.35 18.89 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.301 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.45 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 11.8 m -79.81 10.09 4.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.728 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 67.84 -82.29 0.17 Allowed Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.427 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -48.79 78.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.021 0.438 . . . . 0.0 110.156 179.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.608 HG11 ' HG ' ' A' ' 61' ' ' LEU . 2.1 t -72.67 -44.26 60.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.675 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.558 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 3.7 tmm_? -59.03 -48.34 81.96 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.849 0.357 . . . . 0.0 110.444 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 72.7 m -67.1 -36.77 82.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.787 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.05 -30.0 60.07 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.676 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.462 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -80.73 -40.23 25.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.646 0.26 . . . . 0.0 110.846 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.531 ' HA ' HG12 ' A' ' 103' ' ' VAL . . . -49.83 -45.36 50.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.732 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 3.7 ptp85 -72.24 -25.61 61.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.579 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.416 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 41.9 m -67.19 -35.54 79.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.763 -179.397 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.6 HD22 HD12 ' A' ' 62' ' ' LEU . 4.0 mm? -55.55 -59.95 4.11 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.837 0.351 . . . . 0.0 110.724 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -64.18 -25.76 68.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.968 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.416 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 11.8 mt-30 -61.54 -43.98 97.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.212 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.434 HG12 ' HG3' ' A' ' 50' ' ' GLN . 64.8 mt -70.22 -60.86 2.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.271 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.417 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 66.59 108.37 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.788 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.489 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 152.29 -176.26 30.62 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.653 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -71.55 -31.85 67.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.339 . . . . 0.0 110.971 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.577 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.09 -54.03 49.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.577 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 9.3 p -70.65 -24.42 25.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.135 0.493 . . . . 0.0 110.816 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -57.31 -26.82 61.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.118 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.27 -26.93 47.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.987 0.422 . . . . 0.0 110.674 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.25 -46.56 60.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.305 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.499 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.92 -33.66 70.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.867 0.365 . . . . 0.0 110.566 179.837 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.4 -41.34 98.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.428 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -70.72 -24.49 62.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.025 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.454 HD22 ' O ' ' A' ' 100' ' ' ALA . 0.3 OUTLIER -84.86 -30.08 24.76 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.08 67.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.619 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.33 -25.78 39.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.343 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.3 p -117.1 21.39 13.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.33 179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.426 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.52 119.77 15.31 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 114.946 -1.024 . . . . 0.0 113.46 -178.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 29.8 m -139.76 129.87 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.556 -0.322 . . . . 0.0 110.361 179.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.73 -143.47 48.65 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.757 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -63.9 -30.34 71.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.756 0.312 . . . . 0.0 111.527 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.454 ' O ' HD22 ' A' ' 92' ' ' LEU . . . -54.15 -34.38 60.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.117 -179.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.426 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 60.3 ttt180 -70.86 -58.95 3.09 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.573 ' HG3' ' ND2' ' A' ' 106' ' ' ASN . 20.9 ttmm -45.84 -25.45 0.52 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.171 0.51 . . . . 0.0 111.082 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.531 HG12 ' HA ' ' A' ' 74' ' ' ALA . 37.7 t -67.41 -48.29 77.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.375 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.499 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -64.85 -59.31 4.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.567 0.699 . . . . 0.0 112.251 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.447 HG21 ' H ' ' A' ' 106' ' ' ASN . 0.0 OUTLIER -59.39 -63.01 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 114.731 -1.122 . . . . 0.0 113.973 -177.955 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.573 ' ND2' ' HG3' ' A' ' 102' ' ' LYS . 16.0 m-80 -55.53 -25.59 38.37 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.417 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 2.1 t80 -59.0 -35.85 73.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.039 0.447 . . . . 0.0 109.927 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.495 HD23 ' HE1' ' A' ' 89' ' ' MET . 46.3 mt -52.57 -22.53 5.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.717 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -64.25 -6.29 6.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.541 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.2 m -117.12 -47.6 2.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.742 0.306 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 85.8 m-70 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.93 179.701 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.0 mtt . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.615 0.245 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.46 -83.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.574 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -110.19 -174.76 2.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.812 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 61.8 -83.87 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.206 179.879 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -78.84 98.16 6.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.862 0.363 . . . . 0.0 110.806 -179.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.477 ' NZ ' ' HB2' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -158.31 -23.92 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.784 179.825 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.543 ' HA ' ' HG3' ' A' ' 10' ' ' ARG . 36.9 p-90 -88.03 16.5 5.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.763 179.668 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 45.7 t -96.72 -9.16 9.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.182 -179.838 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.657 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 38.8 mtt180 -129.49 15.19 6.04 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.561 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.543 ' HG3' ' HA ' ' A' ' 7' ' ' TRP . 96.4 mtt180 -63.26 103.89 0.54 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.332 -1.359 . . . . 0.0 107.332 177.468 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 64.63 31.27 12.24 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -176.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.657 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 3.6 p -40.07 143.88 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.338 -179.448 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.42 ' HG ' HG21 ' A' ' 14' ' ' THR . 11.6 t -177.32 -85.92 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.962 -178.633 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.42 HG21 ' HG ' ' A' ' 13' ' ' SER . 70.2 p -98.13 101.56 13.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.013 179.318 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.427 ' HA ' ' HG3' ' A' ' 19' ' ' MET . . . -88.29 -68.62 0.75 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.301 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.493 ' HA ' ' HB2' ' A' ' 23' ' ' ALA . 1.8 pt? -60.28 -13.84 14.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.705 -178.703 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.6 t -67.46 -50.61 58.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.681 0.277 . . . . 0.0 110.867 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -171.13 93.22 0.17 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.252 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.489 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 20.1 mmt -133.48 -43.5 0.84 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.155 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 88.73 -34.49 3.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.525 -179.771 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -141.14 -40.04 0.4 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.794 0.33 . . . . 0.0 110.819 -179.975 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -68.34 -6.95 27.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.783 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.493 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . . . -104.75 -10.55 17.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.27 -179.795 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -61.87 -48.76 79.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.595 179.582 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.4 -55.29 36.76 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.735 179.644 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 40.4 Cg_exo -50.56 -21.33 7.54 Favored 'Trans proline' 0 C--N 1.359 1.106 0 C-N-CA 121.838 1.692 . . . . 0.0 110.432 179.058 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.605 HD22 ' HA ' ' A' ' 46' ' ' ILE . 1.3 tp -86.32 -38.11 17.82 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.138 -1.392 . . . . 0.0 109.966 179.768 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.569 HD13 HD13 ' A' ' 31' ' ' LEU . 15.1 tp -74.58 -21.89 59.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.41 179.208 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.53 -35.23 75.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.878 -179.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.0 m -63.71 -24.48 67.79 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.514 -179.665 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.569 HD13 HD13 ' A' ' 28' ' ' LEU . 90.1 mt -67.46 -16.59 64.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.12 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.4 m -100.27 12.16 37.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.793 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -85.36 144.19 28.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.057 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -67.53 -29.42 68.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.035 -179.921 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -75.93 144.92 40.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.055 -179.831 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.502 ' HB2' HG22 ' A' ' 69' ' ' VAL . 58.1 p-90 -89.39 -31.93 17.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.748 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.4 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 4.9 tmt_? -58.96 -35.43 73.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.654 179.616 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 mm -82.74 -47.02 18.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.542 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.5 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 51.3 ttp180 -57.43 -42.07 81.67 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.772 -179.273 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -55.95 -63.08 5.62 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.739 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.7 -25.98 0.84 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.65 0.262 . . . . 0.0 111.596 -179.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.424 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -64.11 -57.0 10.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.794 0.33 . . . . 0.0 110.397 179.529 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.95 -24.95 68.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.499 179.475 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.426 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 8.1 m95 -61.2 -44.91 96.54 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.154 -179.489 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.435 ' HA ' HD21 ' A' ' 48' ' ' ASN . 27.8 mm -98.78 -19.05 6.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -178.886 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.605 ' HA ' HD22 ' A' ' 27' ' ' LEU . 5.8 tt -56.43 -34.25 40.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -178.499 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.42 -19.02 79.73 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.567 -0.825 . . . . 0.0 113.184 -179.277 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.435 HD21 ' HA ' ' A' ' 45' ' ' ILE . 28.9 m-80 -70.87 2.39 4.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.376 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -107.06 -18.43 13.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -179.545 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.553 ' HG3' HG12 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 55.97 56.54 5.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.807 0.336 . . . . 0.0 111.249 -179.679 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -127.61 161.16 29.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.023 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.405 ' HA ' HG22 ' A' ' 55' ' ' VAL . 13.1 pt-20 -65.86 -30.6 71.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.692 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.504 ' HD3' HD23 ' A' ' 28' ' ' LEU . 17.2 ttm180 -69.17 -10.89 59.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.69 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.3 3.17 27.34 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.066 -179.557 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.543 HG23 HH12 ' A' ' 84' ' ' ARG . 64.5 t -83.2 -55.09 7.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.173 -178.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.468 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 18.9 tt0 -59.17 -49.01 95.26 Favored Pre-proline 0 CA--C 1.532 0.271 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.69 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 90.4 Cg_exo -42.94 -32.33 2.63 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.484 2.123 . . . . 0.0 112.732 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.608 ' HA ' ' HB2' ' A' ' 73' ' ' ALA . 4.8 mt -73.35 -52.71 12.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.736 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 38.5 mm -49.25 -50.75 15.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.968 -179.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.99 -32.85 71.26 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -178.629 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.498 ' HG ' HG12 ' A' ' 69' ' ' VAL . 5.2 tp -89.82 -12.41 39.21 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.895 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.536 HD22 ' HA ' ' A' ' 74' ' ' ALA . 17.0 mt -72.97 -13.84 61.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.881 0.372 . . . . 0.0 111.1 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -116.03 9.78 14.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.101 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.07 -31.75 71.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.265 0.555 . . . . 0.0 110.931 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 23.3 m-20 51.9 25.14 2.88 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.237 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.466 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.9 t -86.22 -17.15 35.54 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.758 0.314 . . . . 0.0 110.825 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.76 -110.22 1.6 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.311 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.426 ' HD1' ' NE1' ' A' ' 44' ' ' TRP . 0.1 OUTLIER -60.33 -26.58 66.68 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.469 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.502 HG22 ' HB2' ' A' ' 36' ' ' TRP . 24.3 t -69.46 -30.04 44.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.628 178.685 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.463 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 57.5 ttp180 -78.38 -55.74 5.0 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.464 179.391 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.46 ' O ' ' HG3' ' A' ' 75' ' ' ARG . 46.2 m -62.37 -28.0 69.47 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.967 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.5 -59.98 9.79 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.583 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.608 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . . . -60.68 -27.94 68.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.786 0.327 . . . . 0.0 110.911 179.984 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.536 ' HA ' HD22 ' A' ' 62' ' ' LEU . . . -61.9 -45.15 95.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.573 -179.775 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.505 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 28.5 mtp85 -62.2 -33.47 74.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.412 -179.578 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.8 m -50.74 -46.48 59.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.846 -178.358 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.437 HD13 ' H ' ' A' ' 77' ' ' LEU . 5.7 mp -56.96 -55.76 30.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.844 0.354 . . . . 0.0 110.133 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -59.1 -32.76 70.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.281 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 29.6 mt-30 -65.32 -30.74 71.62 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.803 0.335 . . . . 0.0 110.776 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.553 HG12 ' HG3' ' A' ' 50' ' ' GLN . 90.1 mt -90.06 -60.88 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.3 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.51 113.66 0.01 OUTLIER Glycine 0 C--N 1.331 0.27 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.016 179.754 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.402 ' H ' ' HB2' ' A' ' 111' ' ' HIS . . . 160.03 174.89 30.39 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.629 179.851 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.3 -32.77 74.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.809 0.338 . . . . 0.0 111.004 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.586 HH11 HG11 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -61.48 -54.85 37.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.469 179.948 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.586 HG11 HH11 ' A' ' 84' ' ' ARG . 0.0 OUTLIER -70.72 -21.62 22.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.834 179.213 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -56.44 -27.79 57.68 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.712 179.921 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.62 -27.55 45.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.241 179.69 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.69 -47.08 79.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.666 179.497 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.618 ' HE1' ' HB1' ' A' ' 104' ' ' ALA . 3.0 ppp? -67.57 -25.91 66.02 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.76 0.314 . . . . 0.0 110.215 179.735 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.442 ' N ' ' SD ' ' A' ' 89' ' ' MET . 37.0 mt-10 -69.03 -39.27 79.32 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.707 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -69.46 -31.2 69.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.908 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.415 ' O ' ' N ' ' A' ' 96' ' ' GLY . 0.5 OUTLIER -85.73 -24.29 26.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.096 -179.945 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.99 -28.76 70.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.68 179.391 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -80.34 -25.01 39.46 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.048 0.451 . . . . 0.0 110.011 179.627 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.0 p -111.99 17.48 19.63 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.393 179.215 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.424 ' HA3' ' CD ' ' A' ' 101' ' ' ARG . . . -55.76 121.5 23.4 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.887 -179.346 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.6 t -139.81 130.11 25.32 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.432 -0.384 . . . . 0.0 111.267 179.455 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 51.58 -113.23 2.24 Favored Glycine 0 C--N 1.33 0.215 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.743 179.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -78.71 -33.32 46.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.756 0.312 . . . . 0.0 110.91 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.471 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.57 -39.46 64.83 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.61 -179.929 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.424 ' CD ' ' HA3' ' A' ' 96' ' ' GLY . 8.5 tpt180 -66.66 -61.28 2.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.677 0.275 . . . . 0.0 111.341 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -48.26 -26.78 2.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.884 -179.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 8.5 t -61.13 -52.7 58.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.022 179.53 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.618 ' HB1' ' HE1' ' A' ' 89' ' ' MET . . . -64.84 -59.81 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.124 -179.475 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 52.1 t -52.58 -63.03 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.934 -178.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -56.03 -33.94 65.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -178.844 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -61.08 -25.57 67.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.028 0.442 . . . . 0.0 111.067 -179.398 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.439 ' HG ' ' HE3' ' A' ' 89' ' ' MET . 81.1 mt -57.89 -21.53 43.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.735 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -96.29 7.04 47.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.77 -179.16 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 66.8 p -119.97 -16.46 8.63 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -179.125 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.406 ' HD2' ' HA ' ' A' ' 108' ' ' LEU . 7.9 p80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.066 -0.969 . . . . 0.0 110.81 -179.746 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptp . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 120.612 0.244 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.34 101.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.899 -179.656 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.2 t70 68.87 -2.75 1.63 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.962 -179.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -128.63 95.44 4.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.753 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 61.12 107.51 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.326 179.966 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -127.41 -15.53 5.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.602 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.422 ' C ' ' H ' ' A' ' 9' ' ' ARG . 19.7 p-90 -140.04 25.4 2.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.641 179.849 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.453 HG23 ' HG2' ' A' ' 22' ' ' GLU . 9.1 p -73.67 11.52 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.27 -179.744 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.557 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 73.3 ttt180 -154.05 -3.24 0.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.914 179.749 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -60.88 104.83 0.4 Allowed 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.601 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.6 t70 65.84 34.36 7.37 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -177.475 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.557 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 7.6 p -42.33 154.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.523 -179.195 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.411 ' N ' HG22 ' A' ' 12' ' ' VAL . 9.7 t -159.39 -158.38 0.66 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.858 -178.629 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.52 HG21 ' H ' ' A' ' 15' ' ' ALA . 1.6 m -52.34 170.62 0.06 Allowed 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.566 179.654 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.596 ' HA ' ' HE2' ' A' ' 19' ' ' MET . . . -82.08 -68.65 0.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -178.415 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.43 HD11 ' N ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -86.36 -13.3 46.85 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -178.164 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.513 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 47.3 t -51.78 -53.53 38.84 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.559 -178.916 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.477 ' HB2' ' O ' ' A' ' 17' ' ' SER . 42.9 ttt180 174.37 96.64 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.114 0.259 . . . . 0.0 111.574 179.729 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.596 ' HE2' ' HA ' ' A' ' 15' ' ' ALA . 22.8 mtm -134.23 -9.63 2.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.827 0.346 . . . . 0.0 110.901 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 85.32 -114.86 4.04 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.462 179.982 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -66.97 -24.03 66.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.953 0.406 . . . . 0.0 110.888 179.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.471 ' HB2' ' HE1' ' A' ' 19' ' ' MET . 6.8 mt-10 -82.23 -24.59 34.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.918 -179.544 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.402 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . -95.57 -11.53 27.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.582 -179.568 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.594 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.2 t80 -63.26 -44.64 94.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.038 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.35 -56.17 29.49 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.402 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 89.5 Cg_exo -45.15 -26.85 2.5 Favored 'Trans proline' 0 C--N 1.358 1.052 0 C-N-CA 122.022 1.815 . . . . 0.0 111.269 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.3 mt -71.21 -55.92 7.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.142 -0.936 . . . . 0.0 109.51 178.3 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.461 HD11 HD13 ' A' ' 31' ' ' LEU . 14.8 tp -63.64 -18.49 64.0 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.95 178.814 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -82.91 -30.17 28.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.66 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.453 ' OG ' HG21 ' A' ' 38' ' ' ILE . 44.2 t -65.09 -17.16 64.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.995 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.648 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 89.1 mt -66.28 -20.88 66.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.941 179.978 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.2 m -89.78 19.17 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.605 179.502 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -101.48 131.6 47.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.053 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -66.87 -11.32 55.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.469 -179.658 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -86.38 133.42 33.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.903 0.383 . . . . 0.0 111.329 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 53.8 p-90 -79.03 -32.1 44.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.366 179.423 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -64.97 -50.43 66.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.14 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.453 HG21 ' OG ' ' A' ' 30' ' ' SER . 71.5 mt -66.94 -51.7 51.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.228 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.648 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 32.1 ttm180 -58.59 -24.62 61.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.815 0.341 . . . . 0.0 110.707 -179.944 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.27 -57.55 7.43 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.48 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.17 -37.86 36.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.658 0.266 . . . . 0.0 111.415 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.63 -52.69 64.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.911 0.386 . . . . 0.0 110.758 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.55 76.05 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.12 179.588 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -66.3 -28.92 69.06 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.432 -178.827 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 53.5 mt -100.09 -27.14 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.849 0.357 . . . . 0.0 111.567 -179.026 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.431 HD13 ' HB3' ' A' ' 27' ' ' LEU . 1.1 tt -58.39 -30.95 41.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.023 -178.943 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -68.38 -21.24 74.12 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.513 -179.299 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -70.57 -25.21 62.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.888 0.344 . . . . 0.0 111.9 -179.318 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -69.68 -35.22 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -179.45 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.606 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 41.3 mt-30 64.99 17.62 11.16 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.058 0.456 . . . . 0.0 110.354 -179.964 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -89.56 164.08 14.93 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.236 -179.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -62.9 -36.74 84.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.079 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -68.23 -9.21 45.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.712 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.6 -1.77 29.67 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.479 -179.615 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.6 t -87.57 -35.08 7.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.15 -179.761 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.522 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.6 tm-20 -60.41 -49.6 89.58 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.504 -179.679 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 71.7 Cg_exo -48.19 -50.48 11.94 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.041 1.827 . . . . 0.0 111.993 179.548 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.454 HD23 ' HA ' ' A' ' 73' ' ' ALA . 11.0 mt -57.86 -30.22 65.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.777 -179.381 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 31.4 mm -62.43 -59.1 4.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -70.08 -36.09 74.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.744 0.307 . . . . 0.0 111.485 -179.423 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.554 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -54.6 -55.42 29.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.171 -179.176 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.527 HD22 HD22 ' A' ' 92' ' ' LEU . 16.7 mt -53.91 -12.25 0.54 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.721 0.296 . . . . 0.0 111.188 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -114.29 -15.46 12.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.375 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.1 -41.2 96.25 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.329 0.585 . . . . 0.0 111.256 -179.281 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.626 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 24.1 t70 61.11 28.25 17.97 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.778 -179.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.479 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 56.4 m -82.14 1.11 37.74 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.119 -179.334 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.59 -86.78 1.54 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.528 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -62.65 -44.06 97.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.04 0.448 . . . . 0.0 110.26 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.554 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.8 t -71.2 -39.93 73.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.158 -179.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.626 ' HE ' ' HA ' ' A' ' 65' ' ' ASP . 5.2 ttm180 -68.29 -62.27 1.47 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.688 179.987 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.8 t -53.7 -26.43 22.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.802 179.561 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.34 -46.87 91.34 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.933 179.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.454 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -66.93 -28.58 68.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.702 0.286 . . . . 0.0 110.976 179.516 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.58 -43.89 96.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.815 -179.701 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 3.8 ptp180 -83.05 -37.08 24.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.826 179.808 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.6 m -53.22 -41.31 65.22 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.099 179.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 73' ' ' ALA . 78.4 mt -55.4 -59.32 4.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.888 0.375 . . . . 0.0 110.138 179.049 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -51.88 -32.65 33.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.811 178.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 23.9 mt-30 -66.42 -31.09 71.64 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-O 120.945 0.402 . . . . 0.0 110.366 179.652 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.606 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 90.6 mt -75.91 -61.54 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.464 -179.721 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 57.81 110.63 0.01 OUTLIER Glycine 0 CA--C 1.52 0.389 0 C-N-CA 120.995 -0.622 . . . . 0.0 113.157 179.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 150.82 -165.65 30.2 Favored Glycine 0 C--N 1.33 0.25 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.723 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.553 ' HG3' HH21 ' A' ' 86' ' ' ARG . 1.9 mp0 -72.21 -40.59 67.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.94 0.4 . . . . 0.0 110.643 179.735 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.523 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -54.75 -50.98 67.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.476 179.681 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.523 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 9.9 p -70.85 -27.12 29.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.072 179.4 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.678 ' HG3' ' HE1' ' A' ' 89' ' ' MET . 7.4 ttp180 -58.66 -30.49 67.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.933 -178.764 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.63 -23.37 27.55 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.79 0.292 . . . . 0.0 111.79 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.5 -37.68 71.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.44 -179.327 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.678 ' HE1' ' HG3' ' A' ' 86' ' ' ARG . 9.8 ptt? -72.0 -36.7 69.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.55 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -68.38 -45.27 73.18 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.502 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -60.82 -24.92 66.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.708 179.576 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.527 HD22 HD22 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -86.45 -33.84 20.28 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.403 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.68 -15.23 57.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.062 179.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -84.37 -30.3 25.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.94 179.522 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.5 p -119.82 21.56 11.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.394 179.415 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -50.72 127.0 26.71 Favored Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 114.923 -1.035 . . . . 0.0 113.612 -178.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 t -144.22 130.17 19.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.751 179.015 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 57.89 -152.31 28.06 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.758 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.448 ' HB3' HH12 ' A' ' 70' ' ' ARG . 49.9 t80 -52.77 -33.13 47.21 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.655 0.264 . . . . 0.0 111.348 -179.956 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.448 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -52.3 -40.31 61.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.741 -179.571 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 -71.78 -52.84 15.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.604 -179.597 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -45.61 -26.48 0.61 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.244 0.545 . . . . 0.0 110.51 -179.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 45.6 t -66.93 -57.81 8.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.46 179.617 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.409 ' HB3' ' CD2' ' A' ' 92' ' ' LEU . . . -54.62 -62.17 1.83 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.943 0.719 . . . . 0.0 112.943 -179.135 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.628 HG11 HD21 ' A' ' 106' ' ' ASN . 7.5 p -53.88 -47.1 64.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.721 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.628 HD21 HG11 ' A' ' 105' ' ' VAL . 0.9 OUTLIER -70.79 -35.55 72.61 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.271 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -64.9 -26.18 68.21 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 120.817 0.341 . . . . 0.0 111.385 -178.238 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.425 HD22 ' SD ' ' A' ' 89' ' ' MET . 39.7 mt -49.98 -26.65 4.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.295 179.715 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.53 -6.2 0.67 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.226 -179.399 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 p -114.8 -74.23 0.62 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 13.0 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.916 -179.834 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.6 tpt . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.809 0.338 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.06 141.49 45.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.096 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.7 t70 62.49 177.58 0.14 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.965 179.849 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 65.41 14.77 9.66 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.043 179.681 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.457 ' ND2' HG13 ' A' ' 8' ' ' VAL . 2.4 t-20 -126.96 29.01 5.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.79 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -58.8 -46.71 86.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.008 0.432 . . . . 0.0 110.001 179.414 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -105.12 90.06 3.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.73 179.142 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.457 HG13 ' ND2' ' A' ' 5' ' ' ASN . 1.5 m -84.77 -28.3 6.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.836 -178.713 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.4 tpp180 -114.32 -54.93 2.55 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.003 -179.821 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 1.7 mpp_? -47.65 112.95 0.62 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 178.965 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.447 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 20.4 t70 75.76 90.73 0.08 Allowed 'General case' 0 C--O 1.231 0.131 0 O-C-N 123.656 0.597 . . . . 0.0 110.413 -178.896 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.658 HG23 ' H ' ' A' ' 13' ' ' SER . 3.5 p -171.42 -177.22 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.656 -179.526 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.658 ' H ' HG23 ' A' ' 12' ' ' VAL . 32.6 t 68.98 11.51 8.36 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.001 0.429 . . . . 0.0 111.139 179.53 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.9 t -170.82 -11.77 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.277 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.79 -0.06 57.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.072 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.482 ' H ' HD13 ' A' ' 16' ' ' LEU . 4.8 mp -44.06 -20.94 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.232 -179.291 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 38.7 t -48.32 -32.92 8.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.518 0.199 . . . . 0.0 111.357 179.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -178.21 90.46 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.861 -179.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.455 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 1.6 mmt -133.4 -44.33 0.84 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.663 -179.923 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 120.71 -116.58 3.24 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.346 -0.93 . . . . 0.0 113.34 179.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -90.2 -23.2 21.35 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.08 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.455 ' HG2' ' HB3' ' A' ' 19' ' ' MET . 10.9 pt-20 -66.97 -23.5 65.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.923 0.392 . . . . 0.0 110.385 179.963 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.469 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -103.65 6.92 37.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.709 179.522 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.492 ' CE2' ' HB3' ' A' ' 53' ' ' ARG . 1.1 t80 -59.15 -53.17 61.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.515 179.453 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.443 ' O ' ' HG2' ' A' ' 29' ' ' GLU . 4.2 mm-40 -63.51 -57.13 21.21 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.629 179.106 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 32.9 Cg_exo -50.06 -21.96 7.16 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 121.993 1.795 . . . . 0.0 110.892 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.508 HD22 HG13 ' A' ' 46' ' ' ILE . 1.3 tp -79.31 -42.89 24.71 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 114.632 -1.167 . . . . 0.0 109.87 179.717 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.51 HD12 HD11 ' A' ' 31' ' ' LEU . 18.5 tp -75.6 -21.06 58.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.108 178.844 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 15.4 mm-40 -76.45 -40.69 49.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.519 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.6 p -66.24 -16.29 63.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.491 -179.83 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.51 HD11 HD12 ' A' ' 28' ' ' LEU . 78.2 mt -65.71 -8.71 22.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.727 0.298 . . . . 0.0 111.129 179.955 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.4 t -95.08 8.96 41.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.733 179.71 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.618 HD22 ' HB3' ' A' ' 35' ' ' ASP . 0.8 OUTLIER -81.08 128.84 34.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.169 -179.808 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.17 -27.11 65.37 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.276 -179.084 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.618 ' HB3' HD22 ' A' ' 33' ' ' ASN . 36.7 t70 -75.85 163.0 27.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.793 0.33 . . . . 0.0 111.075 -179.59 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 13.5 p90 -107.67 -31.89 7.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.29 -179.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -59.72 -39.03 83.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.0 mt -80.52 -44.75 21.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.828 179.841 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -65.12 -19.56 66.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.741 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.76 -66.44 2.63 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.531 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.1 -35.78 7.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.795 0.331 . . . . 0.0 111.206 179.755 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.2 -49.45 77.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.54 179.622 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.417 ' HB3' HD21 ' A' ' 61' ' ' LEU . . . -68.12 -34.55 76.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.783 179.452 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -67.23 -27.86 67.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.012 -179.234 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.6 mt -99.16 -28.79 3.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.78 0.324 . . . . 0.0 111.617 -179.256 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.508 HG13 HD22 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -60.86 -28.7 43.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.176 -179.32 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -69.4 -24.73 75.98 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.27 179.666 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -64.68 -32.97 74.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.775 0.321 . . . . 0.0 110.463 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.505 ' C ' ' H ' ' A' ' 51' ' ' ASP . 17.8 m-85 -92.32 108.7 20.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.441 179.581 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.418 HE21 ' HB2' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -76.58 31.26 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.035 0.445 . . . . 0.0 111.005 179.885 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.505 ' H ' ' C ' ' A' ' 49' ' ' PHE . 20.8 t70 -85.52 160.32 19.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.903 -179.931 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.98 -40.28 97.27 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.795 -179.316 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.492 ' HB3' ' CE2' ' A' ' 24' ' ' PHE . 39.6 ttm180 -65.33 -12.28 50.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.133 -179.839 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.422 ' O ' HD12 ' A' ' 58' ' ' LEU . . . -106.11 8.94 32.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.134 -179.143 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.402 HG21 ' O ' ' A' ' 51' ' ' ASP . 40.9 t -92.1 -41.73 13.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.213 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.501 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 5.8 tp10 -55.9 -49.17 94.49 Favored Pre-proline 0 C--N 1.331 -0.236 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.088 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.501 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 97.0 Cg_exo -44.24 -52.93 5.23 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.22 1.947 . . . . 0.0 112.055 -179.963 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.422 HD12 ' O ' ' A' ' 54' ' ' ALA . 6.8 mp -51.44 -40.32 59.15 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.888 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.9 mm -59.82 -60.83 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -70.06 -22.35 63.08 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -179.233 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.631 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -76.23 -44.92 35.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -177.966 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.573 HD13 HD22 ' A' ' 77' ' ' LEU . 31.3 mt -62.21 -9.2 7.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.117 0.484 . . . . 0.0 110.698 -179.032 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -127.38 -2.54 6.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.652 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.423 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 47.7 t0 -61.36 -33.89 74.39 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.338 -179.766 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.65 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 3.7 m-20 59.79 25.68 14.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.796 -179.548 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.488 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.9 m -86.29 8.65 20.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.42 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 74.31 -94.31 0.82 Allowed Glycine 0 C--N 1.333 0.361 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.701 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.66 -42.19 78.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.975 0.417 . . . . 0.0 110.502 179.892 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.631 HG12 ' HG ' ' A' ' 61' ' ' LEU . 25.7 t -71.66 -33.19 48.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.726 -179.666 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.65 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 47.6 ttt180 -73.26 -61.23 1.89 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.01 -179.934 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.2 m -51.65 -30.17 20.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.993 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.51 -43.7 95.84 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.35 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.522 ' HA ' ' HB2' ' A' ' 76' ' ' SER . . . -72.35 -34.04 67.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.795 0.331 . . . . 0.0 110.832 179.718 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.65 -44.11 69.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.567 179.759 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.4 ptp85 -83.02 -28.2 29.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.367 179.348 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.522 ' HB2' ' HA ' ' A' ' 73' ' ' ALA . 58.7 m -62.29 -20.98 64.86 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.189 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.573 HD22 HD13 ' A' ' 62' ' ' LEU . 4.9 mt -66.34 -61.26 2.1 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.734 0.302 . . . . 0.0 110.437 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -61.45 -22.28 64.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.761 178.685 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.491 ' HB2' ' HA ' ' A' ' 76' ' ' SER . 0.0 OUTLIER -65.74 -37.85 87.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.165 179.307 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.481 ' HB ' HG23 ' A' ' 85' ' ' VAL . 77.6 mt -87.61 -60.89 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.085 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.66 125.59 0.02 OUTLIER Glycine 0 C--N 1.331 0.258 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.847 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 147.08 -174.13 26.99 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.992 179.743 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -72.21 -22.11 61.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.939 0.4 . . . . 0.0 111.097 -179.889 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.549 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.18 -46.75 60.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.872 -179.935 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.549 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 12.1 t -70.73 -26.64 28.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.447 179.898 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ppt_? -58.69 -20.03 44.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.445 -179.528 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -82.29 -30.56 30.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.595 179.457 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.25 -40.32 74.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.194 179.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.475 ' O ' ' HB3' ' A' ' 104' ' ' ALA . 16.1 ptt? -71.18 -39.18 72.0 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.723 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -64.73 -26.65 68.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.988 0.423 . . . . 0.0 109.899 179.028 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -64.72 -48.01 76.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.23 179.325 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.555 HD11 ' HB3' ' A' ' 62' ' ' LEU . 54.5 mt -68.49 -35.07 77.0 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.403 179.39 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.469 ' HA ' ' CZ ' ' A' ' 101' ' ' ARG . . . -55.18 -33.56 63.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.834 179.058 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -96.99 -11.92 23.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.155 179.681 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.1 m -92.24 -28.62 16.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.951 0.405 . . . . 0.0 111.065 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 62.7 113.3 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.62 -179.642 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.541 ' H ' ' HB2' ' A' ' 101' ' ' ARG . 14.1 p -146.56 -176.58 5.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.734 0.302 . . . . 0.0 111.032 -179.533 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -83.69 -83.71 0.92 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.512 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -78.52 -40.35 35.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.746 0.307 . . . . 0.0 111.01 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.468 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -57.01 -43.32 81.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.651 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.541 ' HB2' ' H ' ' A' ' 97' ' ' THR . 23.8 tpt85 -59.9 -61.39 2.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.497 -179.384 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 54.2 tttt -50.13 -37.37 33.92 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.174 0.511 . . . . 0.0 110.118 179.63 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 11.9 t -61.5 -41.86 91.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.902 179.369 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.507 ' HB2' HD13 ' A' ' 92' ' ' LEU . . . -64.88 -59.75 3.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.139 -179.473 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.438 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 4.4 p -58.96 -47.16 90.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.819 -178.969 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.402 ' N ' HG13 ' A' ' 105' ' ' VAL . 37.0 t30 -64.67 -32.57 74.29 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.559 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -62.45 -26.92 68.77 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 120.666 0.27 . . . . 0.0 111.143 -178.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -51.94 -26.2 9.9 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.25 179.766 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -55.35 -18.37 6.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.284 179.887 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.0 m -101.99 -74.72 0.62 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.936 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.69 179.576 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.768 0.318 . . . . 0.0 110.674 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.28 -58.76 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.045 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -140.01 -2.12 1.52 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.641 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -81.91 -62.1 1.73 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.738 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 48.8 m-20 -99.71 31.4 3.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.552 179.674 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 54.2 tttm -91.93 -24.01 19.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.226 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 34.3 p-90 -147.04 25.55 1.13 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.413 -179.748 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 p -58.41 96.04 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.142 0.496 . . . . 0.0 111.123 179.942 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.447 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 21.5 ttm180 59.94 9.04 1.59 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.312 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.479 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 31.0 mmm180 -67.11 104.43 1.42 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.951 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 9.3 m-20 69.09 12.19 8.48 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.573 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.556 HG13 ' H ' ' A' ' 14' ' ' THR . 38.3 t -89.82 -88.64 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.648 0.261 . . . . 0.0 111.164 -179.883 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.8 t 55.87 18.83 3.19 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.697 179.733 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.556 ' H ' HG13 ' A' ' 12' ' ' VAL . 9.1 t -141.33 11.54 2.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.02 0.438 . . . . 0.0 111.043 179.87 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.519 ' O ' ' HG3' ' A' ' 19' ' ' MET . . . -83.2 -0.06 47.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.468 -179.781 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.531 ' HA ' ' HE3' ' A' ' 19' ' ' MET . 1.9 pt? -44.01 -17.71 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -178.806 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.425 ' N ' ' O ' ' A' ' 15' ' ' ALA . 88.2 p -60.85 -46.97 88.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.703 0.287 . . . . 0.0 110.504 178.959 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -175.97 102.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.812 179.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.531 ' HE3' ' HA ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -133.08 -43.57 0.87 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.659 -179.577 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.94 6.35 89.51 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.626 -0.797 . . . . 0.0 113.012 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -175.88 -28.64 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.565 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.442 ' H ' ' HB2' ' A' ' 19' ' ' MET . 5.2 mm-40 -73.5 -43.45 60.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.369 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.404 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . -105.86 17.13 24.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -178.369 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.47 ' CE1' ' HB3' ' A' ' 53' ' ' ARG . 2.1 t80 -57.96 -51.34 70.06 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.3 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.419 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -63.37 -57.8 18.56 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.231 179.508 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.419 ' HD3' ' HB2' ' A' ' 25' ' ' GLU . 83.3 Cg_exo -46.57 -25.2 3.3 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 122.065 1.843 . . . . 0.0 111.467 -179.706 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 19.7 mt -77.5 -46.54 22.12 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.894 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.508 HD11 HD13 ' A' ' 31' ' ' LEU . 27.3 tp -68.47 -19.8 64.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.918 178.855 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.58 -23.82 53.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.469 179.824 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.5 m -66.39 -24.08 66.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.132 -179.675 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.552 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 85.3 mt -65.34 -10.77 35.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.842 0.353 . . . . 0.0 110.643 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.6 t -88.67 8.37 28.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.534 179.851 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -102.32 130.04 48.94 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.33 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -68.27 -4.03 12.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.966 179.366 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -77.6 150.54 34.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.734 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 46.9 m0 -88.04 -46.25 9.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.965 -179.973 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -60.29 -37.22 79.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.238 -179.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.9 mt -75.03 -57.28 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.244 -179.781 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.552 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 24.7 ttm180 -59.03 -23.22 61.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.066 -179.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -77.06 -59.07 3.24 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.767 -179.741 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.69 8.37 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.763 0.316 . . . . 0.0 111.502 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.82 -56.53 20.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.769 179.741 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.429 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -65.79 -35.37 80.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.833 179.359 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -55.37 -33.37 63.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.673 -179.582 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.465 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 46.7 mm -99.5 -23.04 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.244 0.545 . . . . 0.0 110.758 -179.835 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.551 HG21 ' HB1' ' A' ' 54' ' ' ALA . 1.0 OUTLIER -60.04 -32.53 50.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.767 -179.209 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.59 -22.2 77.87 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.608 -0.806 . . . . 0.0 113.092 -179.31 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.465 ' ND2' ' HA ' ' A' ' 45' ' ' ILE . 32.1 m-80 -70.74 -8.12 49.87 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.19 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.438 ' HZ ' ' HE1' ' A' ' 19' ' ' MET . 63.2 m-85 -94.97 -26.81 15.95 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.576 ' HG3' HD12 ' A' ' 80' ' ' ILE . 19.2 mp0 57.76 30.52 19.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.995 0.426 . . . . 0.0 111.005 -179.577 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.406 ' O ' HG21 ' A' ' 55' ' ' VAL . 23.6 t70 -102.43 161.02 14.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.995 -179.822 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -62.44 -37.98 88.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.066 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.47 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 17.9 ttm180 -67.09 -9.0 34.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.586 179.741 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.551 ' HB1' HG21 ' A' ' 46' ' ' ILE . . . -103.74 -9.63 18.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.86 -179.26 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.406 HG21 ' O ' ' A' ' 51' ' ' ASP . 68.1 t -82.91 -35.16 12.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.245 -179.827 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.596 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 26.9 tt0 -60.27 -51.37 80.72 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.778 -179.454 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.596 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 54.1 Cg_exo -52.5 -34.86 64.03 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.148 1.898 . . . . 0.0 112.595 179.988 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.53 HD21 ' HA ' ' A' ' 73' ' ' ALA . 8.7 mt -72.18 -27.27 62.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.202 -179.339 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 33.3 mm -63.05 -59.75 3.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.315 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -70.03 -7.02 37.63 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -178.342 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.561 ' HG ' HG13 ' A' ' 69' ' ' VAL . 3.1 mp -89.84 -40.57 12.35 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -177.997 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.648 ' HB3' HD23 ' A' ' 92' ' ' LEU . 4.3 mt -59.68 -14.81 15.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.278 0.561 . . . . 0.0 110.244 -178.888 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -104.46 -27.93 11.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.441 179.136 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 70' ' ' ARG . 34.2 t70 -59.77 138.31 57.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.853 -179.765 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -110.74 39.04 2.32 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.043 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.472 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 67.2 m -86.49 -30.68 21.79 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.283 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 115.54 -92.06 0.57 Allowed Glycine 0 C--N 1.329 0.175 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.032 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -57.96 -31.55 66.99 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.191 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.561 HG13 ' HG ' ' A' ' 61' ' ' LEU . 22.7 t -69.16 -51.2 45.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.05 179.829 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 57.9 ttp180 -61.02 -58.59 7.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.641 -179.816 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 63.9 m -51.05 -27.09 7.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.867 -179.043 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.61 -56.04 26.73 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.292 179.902 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.53 ' HA ' HD21 ' A' ' 58' ' ' LEU . . . -60.2 -38.66 83.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.909 0.336 . . . . 0.0 111.909 179.767 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.05 -44.42 67.42 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -178.71 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.441 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 7.7 ptp180 -84.57 -35.42 22.81 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.269 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.485 ' HA ' HE21 ' A' ' 79' ' ' GLN . 67.4 m -63.39 -36.05 82.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.048 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.668 HD23 HG13 ' A' ' 85' ' ' VAL . 34.5 mt -61.76 -61.07 2.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.571 0.224 . . . . 0.0 111.221 -179.902 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.421 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 38.1 tt0 -62.25 -19.9 63.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.049 0.452 . . . . 0.0 110.395 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.485 HE21 ' HA ' ' A' ' 76' ' ' SER . 8.2 tt0 -62.83 -25.22 68.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.498 179.668 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.576 HD12 ' HG3' ' A' ' 50' ' ' GLN . 2.5 mm -90.79 -60.14 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.056 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.03 98.27 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.775 -0.648 . . . . 0.0 112.46 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 169.35 -174.15 43.73 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.46 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -70.93 -23.85 62.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.736 0.303 . . . . 0.0 110.673 -179.856 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.519 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -62.7 -53.16 58.72 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.646 179.866 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.668 HG13 HD23 ' A' ' 77' ' ' LEU . 93.6 t -70.65 -24.69 25.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.943 0.401 . . . . 0.0 110.692 179.217 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.3 -27.48 35.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.615 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.86 -30.21 23.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.442 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.13 -38.85 72.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.242 179.894 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.543 ' HE2' HD23 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -68.64 -32.84 72.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.671 179.434 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.457 ' HG3' ' HE1' ' A' ' 89' ' ' MET . 39.6 mt-10 -64.9 -42.51 94.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.316 179.3 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -58.73 -38.17 77.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.084 179.793 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.648 HD23 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -86.54 -23.11 25.97 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.462 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.27 -21.32 62.11 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.528 179.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.47 -26.03 38.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.684 179.591 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 82.4 p -119.59 22.93 11.44 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.248 178.775 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -54.38 123.3 27.48 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.009 -0.996 . . . . 0.0 113.594 -178.781 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.0 t -145.95 130.04 17.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.46 -0.37 . . . . 0.0 110.684 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.09 -139.07 47.99 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.066 -0.588 . . . . 0.0 112.879 -179.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -60.8 -31.55 70.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.811 0.338 . . . . 0.0 111.088 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.471 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -54.1 -42.52 69.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.913 -179.404 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -67.11 -58.49 4.78 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -178.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.572 ' HZ3' ' HB2' ' A' ' 102' ' ' LYS . 4.0 ttmp? -45.52 -30.04 1.33 Allowed 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.046 0.451 . . . . 0.0 110.885 -179.497 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 12.2 t -60.24 -57.08 13.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.236 179.511 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.74 -53.59 48.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.283 -179.194 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.8 t -61.28 -62.01 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -178.195 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -55.61 -29.4 59.08 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -178.124 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.421 ' CE1' ' HA ' ' A' ' 78' ' ' GLU . 3.0 t80 -58.84 -32.96 69.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.927 0.394 . . . . 0.0 110.635 -179.479 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.543 HD23 ' HE2' ' A' ' 89' ' ' MET . 37.6 mt -55.28 -23.44 23.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.606 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.98 6.66 8.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.599 -179.826 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.7 m -126.44 -74.93 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.428 -179.863 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.579 -179.959 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ppp? . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.723 0.297 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.32 131.82 51.97 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.029 -179.978 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 57.87 -90.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.897 -179.562 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -172.57 55.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.91 0.386 . . . . 0.0 110.956 179.803 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 57.27 20.89 6.14 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.391 179.555 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.419 ' HB3' HH11 ' A' ' 10' ' ' ARG . 67.6 mttm -89.92 43.98 1.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.087 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 53.5 p-90 -148.15 20.9 1.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.393 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.9 p -90.88 85.03 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.293 0.568 . . . . 0.0 111.184 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.429 ' N ' ' HB3' ' A' ' 22' ' ' GLU . 53.9 ttp180 68.89 6.08 5.38 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.525 179.5 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 48.3 ttt180 -79.27 107.12 11.8 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.241 178.477 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.448 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 21.5 t70 73.59 -3.95 2.35 Favored 'General case' 0 N--CA 1.463 0.183 0 O-C-N 123.543 0.527 . . . . 0.0 111.035 -179.531 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.61 HG11 ' HB1' ' A' ' 15' ' ' ALA . 76.4 t -59.24 -85.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.274 -179.633 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 46.7 t 55.37 -88.25 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.675 0.274 . . . . 0.0 111.475 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.3 p -95.73 14.02 24.55 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.39 -179.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.61 ' HB1' HG11 ' A' ' 12' ' ' VAL . . . -72.51 -1.69 16.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.89 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 pp -50.75 -12.65 0.11 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.749 179.632 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.429 ' H ' ' C ' ' A' ' 15' ' ' ALA . 35.7 t -45.52 -23.59 0.24 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.268 0.469 . . . . 0.0 112.268 -179.691 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 55.9 ttp180 -162.74 -61.54 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 179.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 21.3 ptm -48.83 -43.19 38.3 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 51.47 -154.26 4.47 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.747 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.462 ' H ' ' HE2' ' A' ' 49' ' ' PHE . 11.2 m-20 64.31 -73.78 0.05 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.95 0.405 . . . . 0.0 110.73 -179.54 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.429 ' HB3' ' N ' ' A' ' 9' ' ' ARG . 4.3 mm-40 -63.48 -18.14 63.47 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.214 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.492 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.43 5.9 32.05 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.378 -179.889 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.551 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 4.7 t80 -53.91 -53.8 47.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.692 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.468 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -63.55 -56.06 29.51 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.362 179.0 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.492 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 83.7 Cg_exo -45.34 -27.52 3.2 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.118 1.879 . . . . 0.0 111.821 179.593 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.592 HD11 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -64.89 -59.14 4.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.756 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 25' ' ' GLU . 4.2 pp -68.53 -19.23 64.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.109 0.48 . . . . 0.0 110.161 178.993 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.436 ' N ' HD13 ' A' ' 28' ' ' LEU . 40.3 tt0 -69.65 -34.69 74.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.453 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.422 ' HG ' ' HA ' ' A' ' 39' ' ' ARG . 34.7 t -66.42 -14.99 62.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.383 -179.827 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.525 HD11 ' HG3' ' A' ' 57' ' ' PRO . 95.9 mt -65.65 -10.26 34.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.804 0.335 . . . . 0.0 110.801 179.858 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.3 m -113.61 12.61 18.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.065 -179.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -78.68 143.05 36.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.847 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -67.79 -25.41 65.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.06 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -87.56 135.06 33.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.953 -179.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 27.9 p-90 -82.24 -35.22 28.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.991 -179.897 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.441 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 40.7 ttp180 -58.73 -30.7 67.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.151 179.785 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.0 mm -82.79 -41.19 17.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.353 179.884 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.422 ' HA ' ' HG ' ' A' ' 30' ' ' SER . 39.6 ttm180 -63.63 -40.14 96.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.553 -179.362 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.463 ' HA2' HG12 ' A' ' 69' ' ' VAL . . . -59.09 -60.55 8.67 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.3 -179.892 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.12 -27.79 2.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.638 0.256 . . . . 0.0 111.317 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.43 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.94 -56.33 23.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.839 179.611 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.536 ' HB3' HD23 ' A' ' 58' ' ' LEU . . . -68.94 -25.33 64.5 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.758 0.313 . . . . 0.0 111.215 179.946 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.6 m95 -55.44 -44.96 76.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.054 -179.453 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.9 mm -99.95 -21.07 5.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.022 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.592 HG13 HD11 ' A' ' 27' ' ' LEU . 4.9 tt -58.21 -30.77 40.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.765 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.481 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -65.39 -16.72 63.2 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.955 -179.399 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.649 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.7 OUTLIER -70.81 -25.04 62.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.641 0.258 . . . . 0.0 111.617 -179.573 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.462 ' HE2' ' H ' ' A' ' 21' ' ' ASP . 42.4 m-85 -72.18 -23.63 61.3 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.721 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 56.84 26.21 11.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.932 0.396 . . . . 0.0 111.425 179.83 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -101.99 160.54 14.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.218 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.466 ' O ' HG22 ' A' ' 55' ' ' VAL . 9.8 pt-20 -65.58 -34.14 77.54 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.247 0.546 . . . . 0.0 110.62 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 18.7 ttm180 -69.36 -10.24 57.01 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.415 179.204 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.41 ' C ' ' HD2' ' A' ' 57' ' ' PRO . . . -104.11 -21.07 13.63 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.795 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 52' ' ' GLU . 19.4 m -76.61 -35.99 26.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.113 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.576 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 31.7 tt0 -57.8 -51.88 78.5 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 111.49 0.181 . . . . 0.0 111.49 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.591 ' HG2' HD12 ' A' ' 46' ' ' ILE . 66.6 Cg_exo -52.03 -23.43 16.99 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.131 1.888 . . . . 0.0 112.151 179.399 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.536 HD23 ' HB3' ' A' ' 43' ' ' ALA . 50.6 mt -80.02 -35.97 36.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.496 179.713 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.24 -54.27 37.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.028 -179.588 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -70.12 -14.43 62.65 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -178.366 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.58 ' HG ' HG13 ' A' ' 69' ' ' VAL . 1.5 tp -90.05 -27.45 19.7 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.442 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.589 HD12 HD13 ' A' ' 77' ' ' LEU . 10.1 mt -65.81 -9.77 31.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.139 0.495 . . . . 0.0 110.475 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -121.7 1.8 10.01 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.071 -179.683 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -61.01 -32.15 71.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.19 0.519 . . . . 0.0 111.289 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 52.47 28.65 6.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.333 -0.849 . . . . 0.0 112.02 179.833 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.464 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 7.4 t -85.33 -25.45 27.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.983 0.421 . . . . 0.0 110.818 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.65 -108.83 0.99 Allowed Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.966 -179.832 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.441 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.9 OUTLIER -59.7 -27.46 66.45 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.974 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.58 HG13 ' HG ' ' A' ' 61' ' ' LEU . 17.8 t -66.99 -34.54 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.932 178.968 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -75.73 -49.33 18.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.994 179.16 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 56.7 m -67.1 -21.37 65.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.996 179.414 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -62.74 -63.39 4.67 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.301 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.516 ' HA ' HD21 ' A' ' 58' ' ' LEU . . . -55.23 -25.77 35.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.879 0.371 . . . . 0.0 111.124 179.348 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.441 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.78 -58.28 8.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.55 -179.63 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -64.6 -37.59 88.1 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.324 -179.729 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.481 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 38.6 m -55.79 -38.38 69.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.208 -179.694 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.589 HD13 HD12 ' A' ' 62' ' ' LEU . 15.8 mt -69.73 -60.02 2.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.666 179.303 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.417 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 29.9 mt-10 -51.7 -25.93 8.29 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.245 0.545 . . . . 0.0 109.927 178.436 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.419 ' HB3' ' O ' ' A' ' 76' ' ' SER . 6.3 tt0 -70.11 -44.09 69.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.904 179.164 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.434 ' HB ' HG11 ' A' ' 85' ' ' VAL . 79.9 mt -57.59 -58.43 6.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.201 178.901 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.489 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 70.29 135.41 0.1 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.915 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 124.73 174.81 14.11 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.828 179.685 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -61.79 -22.91 65.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.989 0.423 . . . . 0.0 110.551 179.562 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.508 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -55.13 -63.21 1.23 Allowed 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.829 -179.896 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.434 HG11 ' HB ' ' A' ' 80' ' ' ILE . 5.2 m -70.28 -24.55 25.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.815 179.819 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.409 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 48.6 ttt180 -55.86 -28.71 57.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.498 -178.566 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.19 -26.44 26.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.861 0.363 . . . . 0.0 110.706 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.538 ' HB1' ' HE3' ' A' ' 89' ' ' MET . . . -71.48 -46.18 60.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.087 179.918 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.572 ' HE2' ' HB3' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -72.11 -37.45 69.52 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 179.828 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 30.8 mt-10 -55.56 -37.15 67.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.95 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -81.52 -20.96 38.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.901 179.328 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.481 HD21 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -83.21 -26.13 31.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.663 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.66 -24.85 67.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.728 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -80.04 -22.7 42.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.293 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 30.2 p -120.39 15.93 12.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.173 179.227 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -56.33 127.55 43.92 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 114.794 -1.093 . . . . 0.0 113.468 -178.936 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.0 t -139.78 130.3 25.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.963 0.411 . . . . 0.0 110.55 178.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.6 -132.03 51.29 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.705 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -69.49 -33.92 73.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.635 0.255 . . . . 0.0 111.589 -179.716 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.421 ' O ' HD22 ' A' ' 92' ' ' LEU . . . -49.79 -33.01 15.28 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.008 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.404 ' C ' ' N ' ' A' ' 103' ' ' VAL . 49.9 ttp180 -79.76 -52.52 7.82 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -178.823 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -45.91 -23.24 0.27 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.263 0.554 . . . . 0.0 110.429 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.441 HG21 ' HB1' ' A' ' 74' ' ' ALA . 55.6 t -71.47 -60.24 2.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.341 179.664 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.06 -49.95 67.85 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.208 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.0 t -64.87 -63.23 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.215 -0.902 . . . . 0.0 113.008 -177.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -55.39 -46.29 76.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.626 -178.379 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.489 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 39.2 t80 -60.0 -37.54 80.02 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.196 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.499 ' O ' HD12 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -49.82 -25.31 2.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.373 -178.116 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.2 6.27 1.02 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.683 -179.767 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 110' ' ' THR . . . . . 0.409 ' H ' ' C ' ' A' ' 108' ' ' LEU . 76.8 p -96.4 -71.24 0.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.595 0.236 . . . . 0.0 111.445 -179.887 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 62.4 t-80 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.805 179.964 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.73 0.3 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.77 160.16 19.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.967 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 61.23 170.64 0.1 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.152 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 57.49 18.3 4.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.903 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -127.02 -30.12 2.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.734 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -67.24 -17.01 64.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.91 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 36.6 m95 -114.2 37.71 3.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.002 -179.787 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.1 p -70.54 143.86 14.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.177 179.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.555 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 59.7 ttt180 70.88 8.25 6.48 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.719 179.607 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 70.1 ttt180 -61.63 105.06 0.49 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.382 178.731 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.492 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 3.8 m-20 70.55 2.13 3.96 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.892 -179.226 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.555 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 4.6 t -94.49 166.94 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.846 179.953 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.434 ' N ' HG11 ' A' ' 12' ' ' VAL . 36.5 t -156.9 -39.38 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.944 179.815 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.454 HG22 ' HB3' ' A' ' 17' ' ' SER . 9.7 t -70.22 160.45 32.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.584 179.685 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -96.03 -70.18 0.72 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -179.12 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.452 HD11 ' N ' ' A' ' 17' ' ' SER . 1.3 pp -86.41 -30.75 21.86 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.385 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.454 ' HB3' HG22 ' A' ' 14' ' ' THR . 32.3 t -54.99 -44.52 74.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.649 0.261 . . . . 0.0 111.018 -179.404 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 21.7 ttp180 -168.07 110.12 0.59 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.118 179.617 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -133.06 -39.5 0.94 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.471 179.525 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 102.94 -88.37 0.65 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.773 179.576 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -125.04 13.06 8.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.611 0.243 . . . . 0.0 111.154 -179.56 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -100.08 -45.03 5.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.862 -179.79 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.586 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -106.72 13.13 28.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.631 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.536 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -61.04 -51.12 70.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.984 0.421 . . . . 0.0 110.584 179.904 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -62.94 -52.99 59.5 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.1 179.806 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.586 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 74.3 Cg_exo -40.61 -28.93 0.36 Allowed 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 122.257 1.972 . . . . 0.0 111.722 179.285 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 49.2 mt -72.64 -55.04 7.46 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.101 178.714 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.571 HD12 HD13 ' A' ' 31' ' ' LEU . 23.8 tp -63.09 -22.9 67.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.167 179.021 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -83.18 -34.17 26.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.996 179.763 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.3 t -66.23 -16.18 63.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.901 179.772 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.571 HD13 HD12 ' A' ' 28' ' ' LEU . 80.3 mt -63.4 -13.22 37.42 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.877 -179.999 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 90.3 p -100.64 22.34 12.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.773 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.01 146.18 27.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.963 -179.827 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -66.44 -20.9 66.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.385 -179.784 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -83.87 162.8 20.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.379 . . . . 0.0 111.176 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 14.5 p90 -103.11 -40.34 6.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.175 -179.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -61.72 -30.34 70.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.137 -179.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 31.8 mm -78.51 -42.05 25.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.452 -179.431 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.431 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 41.6 ttm180 -62.96 -44.7 95.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.302 -179.632 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.24 -57.92 12.05 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.892 -179.679 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.89 -28.9 4.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.718 0.294 . . . . 0.0 111.582 -179.811 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.428 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -63.7 -50.56 68.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.951 179.862 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.41 ' CB ' HD22 ' A' ' 61' ' ' LEU . . . -74.82 -25.23 58.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.432 -179.893 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -60.63 -37.98 83.25 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.408 -179.878 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.2 mm -99.53 -19.77 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.799 -179.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.428 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 4.3 tt -59.81 -36.79 68.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -178.417 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.412 ' HA2' HD12 ' A' ' 80' ' ' ILE . . . -70.97 -7.44 62.27 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.465 -0.874 . . . . 0.0 113.39 -179.099 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.545 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.9 OUTLIER -70.78 -26.45 63.34 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -179.241 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -87.03 -27.03 23.44 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.813 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.548 ' HG3' HD13 ' A' ' 80' ' ' ILE . 1.1 mp0 60.74 60.94 1.78 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.76 0.314 . . . . 0.0 111.524 -179.607 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -127.99 176.95 7.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.787 179.47 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -64.22 -34.23 77.61 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.931 179.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.498 ' HE ' ' HA ' ' A' ' 53' ' ' ARG . 1.8 mmp_? -68.56 -11.44 59.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.252 -179.899 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.39 10.38 33.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.956 -179.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.5 t -91.54 -58.49 3.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.056 -179.275 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.434 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 39.4 tt0 -60.5 -46.28 97.37 Favored Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.094 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.465 ' HG3' HD11 ' A' ' 28' ' ' LEU . 95.2 Cg_exo -43.67 -48.08 9.07 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.191 1.927 . . . . 0.0 112.647 -179.898 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.505 HD21 ' HA ' ' A' ' 73' ' ' ALA . 10.3 mt -59.74 -36.51 76.76 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.276 -179.477 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.489 HD12 ' HB1' ' A' ' 88' ' ' ALA . 40.2 mm -61.39 -61.15 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.181 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.9 ptpt -70.25 -11.91 61.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.978 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.614 HD21 ' H ' ' A' ' 73' ' ' ALA . 1.3 tp -89.97 -45.75 8.98 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -177.821 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 58' ' ' LEU . 3.9 pp -67.26 -8.38 31.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 111.291 -178.438 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -101.71 -4.32 26.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.189 -179.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.417 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 2.1 m-20 -61.3 -33.85 74.25 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.61 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.6 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 38.4 m-20 59.6 27.58 16.82 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.183 -179.35 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.457 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 11.7 m -82.12 -31.83 30.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.59 -179.335 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 135.78 -109.36 0.74 Allowed Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.792 -179.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -58.14 -28.71 64.95 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.757 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.457 ' HB ' ' HB2' ' A' ' 66' ' ' SER . 49.4 t -65.5 -45.9 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.477 178.688 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.6 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 53.0 ttp180 -62.0 -48.88 78.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.389 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.9 m -67.12 -24.8 65.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.205 -179.993 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -55.37 -69.78 1.16 Allowed Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.386 -179.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.614 ' H ' HD21 ' A' ' 61' ' ' LEU . . . -47.56 -31.98 4.94 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 179.295 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.86 -47.64 84.1 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.26 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -71.29 -40.3 70.95 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.157 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.588 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 6.7 p -54.46 -27.85 40.37 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.692 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.572 ' HB3' HG12 ' A' ' 85' ' ' VAL . 17.6 mt -55.12 -60.69 3.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.743 0.306 . . . . 0.0 110.696 179.944 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.429 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 34.2 mt-10 -48.88 -36.9 18.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.989 178.262 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.588 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 22.1 mt-30 -67.3 -30.4 70.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.855 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.548 HD13 ' HG3' ' A' ' 50' ' ' GLN . 50.6 mm -80.1 -60.48 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.337 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.585 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . 150.45 142.89 3.63 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.479 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.446 ' O ' ' HB2' ' A' ' 86' ' ' ARG . . . -69.27 -50.03 35.66 Favored Glycine 0 C--O 1.223 -0.569 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.16 -179.475 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -55.27 -35.94 65.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.586 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.585 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.0 OUTLIER -86.2 -58.59 2.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.005 0.431 . . . . 0.0 111.484 -179.046 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.572 HG12 ' HB3' ' A' ' 77' ' ' LEU . 75.7 t -60.09 -21.75 22.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.734 -179.489 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 12.1 ttp180 -52.95 -31.17 38.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.926 0.393 . . . . 0.0 110.608 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.05 -33.29 70.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.775 179.219 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.489 ' HB1' HD12 ' A' ' 59' ' ' ILE . . . -71.58 -46.27 59.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.441 179.444 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.524 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 24.8 mmm -63.08 -48.95 76.42 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.819 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -51.27 -33.27 27.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.617 178.829 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 60.7 tptt -79.03 -26.41 43.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.0 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.645 HD22 ' HB2' ' A' ' 104' ' ' ALA . 2.0 tp -82.29 -25.55 33.89 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.566 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.93 -22.5 65.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.269 0.557 . . . . 0.0 109.604 178.897 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -80.25 -29.75 38.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.556 179.041 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 15.5 p -108.61 19.05 20.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.673 178.97 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.498 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -51.51 114.14 2.82 Favored Glycine 0 N--CA 1.447 -0.597 0 CA-C-N 115.237 -0.892 . . . . 0.0 113.235 -179.117 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.0 t -139.8 130.1 25.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.857 0.36 . . . . 0.0 110.799 179.348 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.29 -127.85 44.59 Favored Glycine 0 CA--C 1.519 0.326 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.862 179.929 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 70' ' ' ARG . 24.6 t80 -74.04 -31.52 62.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.71 0.29 . . . . 0.0 111.278 -179.808 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.501 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -51.66 -37.05 48.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.032 -179.248 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.498 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 29.6 ttt180 -67.37 -58.61 4.46 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.371 -179.535 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -47.03 -24.77 0.68 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.788 -179.973 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.501 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 55.6 t -66.01 -60.67 2.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.506 179.846 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.645 ' HB2' HD22 ' A' ' 92' ' ' LEU . . . -59.26 -39.66 83.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.901 -179.559 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 38.5 t -64.94 -58.22 8.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.69 -0.687 . . . . 0.0 112.445 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.561 ' N ' HD21 ' A' ' 106' ' ' ASN . 0.8 OUTLIER -68.76 -43.33 76.01 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -178.03 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.524 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 62.6 t80 -60.83 -45.6 93.83 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -178.41 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.489 ' HB3' ' O ' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -50.13 -19.66 0.81 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.709 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -71.27 6.58 1.64 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.765 179.423 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 110' ' ' THR . . . . . 0.425 ' H ' ' C ' ' A' ' 108' ' ' LEU . 26.5 p -92.91 -40.46 10.59 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.017 0.436 . . . . 0.0 110.109 179.715 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.985 179.333 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.3 mtp . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.95 0.405 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.34 -2.21 1.0 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.938 179.935 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -155.9 -17.31 0.1 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.822 179.99 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -99.46 -55.23 2.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.128 -179.758 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -130.34 130.56 44.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.918 -179.699 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -137.82 -22.45 1.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.144 179.946 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 17.1 p-90 -128.0 22.37 6.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.959 -179.964 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 21.7 t -106.27 -50.35 8.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.012 -179.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.422 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 99.5 mtt180 -122.81 27.68 7.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.103 -179.788 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' C ' ' H ' ' A' ' 12' ' ' VAL . 29.4 ttm180 -58.77 103.2 0.15 Allowed 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.033 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.9 t70 65.16 -1.28 0.92 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.354 -179.968 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.422 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 25.8 t -81.95 -96.99 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.31 -179.422 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.4 m 48.92 27.45 1.63 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-O 120.741 0.305 . . . . 0.0 111.332 -179.862 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.595 ' HA ' ' HA ' ' A' ' 18' ' ' ARG . 98.2 m -149.21 97.88 2.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.69 -179.736 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.589 ' N ' ' H ' ' A' ' 20' ' ' GLY . . . -96.06 -73.75 0.58 Allowed 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.805 179.383 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -91.42 -68.95 0.76 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.142 0.496 . . . . 0.0 109.812 177.963 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 37.1 t -92.27 -52.79 4.51 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.857 177.983 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.595 ' HA ' ' HA ' ' A' ' 14' ' ' THR . 70.2 ttt180 175.0 73.5 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.098 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.53 ' H ' ' H ' ' A' ' 15' ' ' ALA . 24.9 mtt -133.25 -44.44 0.85 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.796 0.331 . . . . 0.0 111.383 -179.587 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.589 ' H ' ' N ' ' A' ' 15' ' ' ALA . . . 73.14 114.16 0.07 OUTLIER Glycine 0 CA--C 1.519 0.324 0 C-N-CA 121.1 -0.571 . . . . 0.0 113.231 179.537 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 58.3 9.3 0.99 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 179.492 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -106.94 -34.26 7.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.991 0.424 . . . . 0.0 110.043 179.524 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HB1' ' HB1' ' A' ' 15' ' ' ALA . . . -105.26 18.72 21.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.992 179.761 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.8 t80 -55.33 -53.19 59.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.333 179.5 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.39 -57.05 21.94 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.573 178.996 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.515 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 96.4 Cg_exo -41.74 -33.2 1.84 Allowed 'Trans proline' 0 C--N 1.359 1.109 0 C-N-CA 122.321 2.014 . . . . 0.0 111.607 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 22.8 mt -61.93 -58.25 8.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.927 178.706 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.509 HD11 HD11 ' A' ' 31' ' ' LEU . 11.0 tp -64.75 -21.15 66.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.911 178.693 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -74.38 -33.16 62.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.258 179.828 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.1 m -66.44 -17.34 64.73 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.753 -179.753 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.509 HD11 HD11 ' A' ' 28' ' ' LEU . 81.8 mt -65.49 -6.75 11.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.838 0.352 . . . . 0.0 110.804 179.852 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 53.1 m -121.62 17.07 11.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.356 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.447 HD22 ' HB3' ' A' ' 35' ' ' ASP . 11.4 t30 -88.04 137.19 32.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.858 -179.785 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -53.28 -37.48 62.23 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.584 -179.575 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.447 ' HB3' HD22 ' A' ' 33' ' ' ASN . 16.9 t70 -76.09 133.65 40.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.705 -179.672 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -92.03 -27.27 17.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.363 -179.559 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 -60.61 -36.17 77.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.139 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.8 mt -81.91 -38.92 16.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.17 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.472 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.6 ttm180 -56.43 -26.07 52.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.597 179.85 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.42 -63.27 3.46 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.219 179.723 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.82 -24.36 1.41 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.791 0.329 . . . . 0.0 111.346 179.787 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.413 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.98 -57.17 13.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.348 -179.957 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.16 -24.75 62.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.89 0.376 . . . . 0.0 111.195 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.417 ' NE1' ' HA2' ' A' ' 72' ' ' GLY . 6.5 m95 -55.42 -44.69 76.5 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.253 -178.884 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.4 mt -99.11 -20.4 5.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.755 0.312 . . . . 0.0 111.706 -179.381 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.568 HG12 ' HA ' ' A' ' 54' ' ' ALA . 1.4 tt -55.48 -34.12 33.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.681 -179.086 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.23 -27.57 72.55 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.783 -0.723 . . . . 0.0 113.334 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -70.73 -0.04 8.04 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.356 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -91.51 -38.22 12.66 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 -179.829 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.504 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.0 OUTLIER 69.57 44.96 0.84 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.272 0.558 . . . . 0.0 110.714 179.831 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.414 ' O ' HG21 ' A' ' 55' ' ' VAL . 4.9 m-20 -126.94 164.06 22.29 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.907 -179.843 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -61.57 -40.78 95.98 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.103 -179.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.468 ' HG3' HD21 ' A' ' 28' ' ' LEU . 14.0 ttm180 -67.25 -9.65 42.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.798 179.889 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.568 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -104.25 -8.89 19.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.14 -179.003 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.414 HG21 ' O ' ' A' ' 51' ' ' ASP . 71.2 t -91.72 -36.73 8.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.517 -179.767 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.592 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 13.5 tt0 -60.27 -51.93 76.74 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -179.395 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.592 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 51.0 Cg_exo -54.99 -17.67 14.87 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 122.273 1.982 . . . . 0.0 112.821 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.424 HD12 HD13 ' A' ' 77' ' ' LEU . 14.5 mt -85.82 -36.06 20.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.965 -179.76 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.6 mm -61.15 -53.34 50.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.801 -179.452 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -70.03 -13.71 62.35 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.88 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.556 ' HG ' HG11 ' A' ' 69' ' ' VAL . 1.9 mp -89.86 -36.36 15.11 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -177.961 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.523 HD11 HD23 ' A' ' 92' ' ' LEU . 9.0 mt -63.48 -9.16 11.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.836 0.351 . . . . 0.0 111.132 -178.34 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -111.78 -11.88 13.9 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.365 -179.823 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.404 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 3.0 t70 -61.07 -32.49 72.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.12 0.486 . . . . 0.0 111.111 179.978 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.4 t70 47.61 30.35 1.71 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.793 179.885 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.44 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 22.7 t -86.28 -36.26 19.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.864 0.364 . . . . 0.0 111.426 -179.767 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 130.2 -96.95 0.37 Allowed Glycine 0 C--O 1.228 -0.253 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 -178.875 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.06 -32.61 55.17 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.966 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.556 HG11 ' HG ' ' A' ' 61' ' ' LEU . 16.3 t -73.77 -59.99 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.032 179.286 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.418 ' HA ' ' O ' ' A' ' 61' ' ' LEU . 7.6 tmm_? -69.4 -63.33 1.09 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.675 -179.209 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 22.9 t -51.76 -24.89 6.51 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.005 0.431 . . . . 0.0 110.764 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.417 ' HA2' ' NE1' ' A' ' 44' ' ' TRP . . . -63.51 -61.25 6.43 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.699 -0.762 . . . . 0.0 111.714 179.347 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.51 -25.47 68.04 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.722 0.296 . . . . 0.0 110.973 179.243 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -52.42 -46.26 66.28 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.115 -179.366 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.454 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 11.5 ptp180 -81.34 -30.77 33.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.776 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.49 ' HA ' HE21 ' A' ' 79' ' ' GLN . 14.7 m -53.19 -44.14 67.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.353 -179.673 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.672 ' HB3' ' HE1' ' A' ' 89' ' ' MET . 9.0 mp -55.47 -59.61 4.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.836 179.766 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -52.37 -31.23 32.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.472 179.489 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.49 HE21 ' HA ' ' A' ' 76' ' ' SER . 34.0 mt-30 -62.95 -36.94 85.13 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.911 0.386 . . . . 0.0 110.395 179.631 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.504 HG23 ' HG3' ' A' ' 50' ' ' GLN . 69.2 mt -71.63 -55.2 14.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.543 179.432 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.543 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 63.12 -175.57 8.22 Favored Glycine 0 N--CA 1.453 -0.218 0 CA-C-N 115.979 -0.555 . . . . 0.0 113.383 179.407 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.563 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 73.49 168.35 14.98 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.349 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.43 ' HG3' HH21 ' A' ' 86' ' ' ARG . 40.2 tt0 -55.65 -21.12 16.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.927 0.394 . . . . 0.0 110.724 179.621 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.563 HH11 ' HA3' ' A' ' 82' ' ' GLY . 2.7 mpt_? -60.84 -65.6 0.66 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.242 -178.855 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.52 HG21 ' HE3' ' A' ' 89' ' ' MET . 2.5 p -70.88 -23.13 23.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.181 0.515 . . . . 0.0 110.105 179.492 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.43 HH21 ' HG3' ' A' ' 83' ' ' GLU . 23.2 ttp180 -54.61 -19.46 6.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.273 -179.815 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -79.56 -36.65 37.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.43 -35.87 72.76 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.606 179.607 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.672 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 8.4 mmt -59.23 -62.74 1.66 Allowed 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.86 178.987 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -51.56 -36.55 45.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.93 179.394 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -73.53 -28.16 61.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.589 -179.825 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.631 HD22 ' HB1' ' A' ' 104' ' ' ALA . 2.4 tp -86.19 -27.15 24.71 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.581 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.28 -28.28 64.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.684 179.039 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -80.14 -27.51 39.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.766 179.455 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.4 p -112.16 27.03 10.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.484 179.245 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.556 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -50.53 119.8 7.84 Favored Glycine 0 N--CA 1.448 -0.552 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.818 -178.852 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 t -142.58 130.68 21.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.521 -0.339 . . . . 0.0 110.42 179.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.92 -132.37 19.43 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.318 -179.567 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.07 -15.88 23.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.803 0.335 . . . . 0.0 110.588 179.998 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.444 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -56.93 -37.06 70.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.648 179.638 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.556 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 61.0 ttt180 -57.19 -61.28 2.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.343 179.458 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -53.32 -32.8 50.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.309 179.379 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.444 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 9.6 t -62.45 -51.94 66.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.499 179.974 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.631 ' HB1' HD22 ' A' ' 92' ' ' LEU . . . -56.15 -62.24 1.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -178.914 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.427 HG11 ' N ' ' A' ' 106' ' ' ASN . 6.0 p -57.77 -53.38 45.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.022 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.427 ' N ' HG11 ' A' ' 105' ' ' VAL . 41.2 t30 -61.83 -39.16 90.83 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -178.787 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.543 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 63.4 t80 -62.16 -23.96 66.9 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 120.836 0.35 . . . . 0.0 111.263 -178.613 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.2 mt -53.65 -22.78 9.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.411 -179.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -77.63 7.17 5.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.246 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.0 m -130.05 -52.97 1.12 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.444 -179.548 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.104 -0.95 . . . . 0.0 111.433 -179.95 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 mtt . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.739 0.305 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.92 -174.54 0.09 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.407 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -82.37 -13.41 56.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.902 -179.933 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -77.51 -66.37 0.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.76 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.52 138.3 34.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.895 179.843 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -142.89 -30.38 0.53 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.709 -179.958 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 11.3 p-90 -162.22 36.52 0.12 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.705 179.689 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.2 p -64.38 133.37 29.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.962 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.4 ptt180 50.96 20.41 0.79 Allowed 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.074 179.863 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 46.0 ttt180 -96.86 107.24 19.7 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.79 178.192 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.443 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 19.6 t70 74.92 -3.53 2.58 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 123.401 0.438 . . . . 0.0 110.702 -179.191 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.582 HG13 ' HB1' ' A' ' 15' ' ' ALA . 89.5 t -58.76 -82.85 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.998 -179.95 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 40.7 t 56.34 101.26 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.46 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 59.4 p 47.07 29.18 1.04 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.321 179.177 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.582 ' HB1' HG13 ' A' ' 12' ' ' VAL . . . -89.71 -0.27 57.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.851 179.597 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.494 HD12 ' H ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -44.49 -22.03 0.06 Allowed 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.484 -179.363 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.494 ' H ' HD12 ' A' ' 16' ' ' LEU . 61.6 m -52.01 -40.33 60.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.882 0.372 . . . . 0.0 110.858 179.749 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -168.21 88.71 0.25 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.586 179.724 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.559 ' SD ' ' N ' ' A' ' 20' ' ' GLY . 0.0 OUTLIER -133.75 -35.15 0.99 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.671 -179.358 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.559 ' N ' ' SD ' ' A' ' 19' ' ' MET . . . 116.56 -109.72 2.0 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.696 -179.386 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.471 ' HA ' ' HB2' ' A' ' 24' ' ' PHE . 20.1 t70 -106.97 -11.5 15.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.673 0.273 . . . . 0.0 111.105 -179.7 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -59.21 -44.21 92.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.131 -179.371 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.475 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . -105.64 15.05 27.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.135 179.659 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 3.1 t80 -49.44 -44.65 45.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.537 178.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -63.48 -56.71 24.31 Favored Pre-proline 0 N--CA 1.465 0.297 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.307 -179.584 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.475 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 70.5 Cg_exo -37.39 -25.24 0.06 OUTLIER 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 122.863 2.376 . . . . 0.0 112.759 179.244 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 27.1 mt -72.33 -54.26 9.99 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.742 179.215 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 46' ' ' ILE . 12.9 mt -67.96 -26.06 65.75 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.134 179.044 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -63.72 -41.04 98.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.497 -179.614 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.2 m -66.05 -15.45 63.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.578 -179.765 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.531 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 88.1 mt -67.63 -10.98 57.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.726 0.298 . . . . 0.0 111.056 -179.728 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.5 t -98.09 15.88 22.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.089 -179.868 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.678 HD22 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -86.69 149.63 24.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.96 0.41 . . . . 0.0 111.12 -179.903 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.74 -37.46 82.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.994 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.13 158.21 32.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.956 -179.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 1.5 p90 -106.25 -21.0 13.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.962 179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -64.76 -51.57 61.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.799 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.0 mt -62.32 -40.41 87.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.439 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.678 ' HB2' HD22 ' A' ' 33' ' ' ASN . 31.1 ttm180 -63.12 -20.98 65.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.534 179.56 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.92 -64.53 3.86 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.549 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.56 -36.31 4.57 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.694 0.283 . . . . 0.0 111.498 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.23 -47.94 83.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.992 0.425 . . . . 0.0 110.338 179.438 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.408 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -69.04 -30.91 69.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.112 179.533 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -70.73 -34.01 71.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.519 -178.704 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 35.9 mt -98.32 -19.34 5.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.82 0.343 . . . . 0.0 111.502 -179.464 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.567 HG21 ' HB1' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -56.1 -35.63 42.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.136 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.21 -18.48 78.06 Favored Glycine 0 C--N 1.329 0.16 0 C-N-CA 120.566 -0.826 . . . . 0.0 113.592 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -58.16 -34.22 70.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.007 0.403 . . . . 0.0 111.098 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.479 ' C ' ' H ' ' A' ' 51' ' ' ASP . 12.0 m-85 -94.07 118.67 31.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.964 0.411 . . . . 0.0 110.963 179.593 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -72.13 20.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.81 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.479 ' H ' ' C ' ' A' ' 49' ' ' PHE . 28.7 t0 -83.8 137.25 33.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.754 0.311 . . . . 0.0 110.552 179.907 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -10.32 32.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.788 -179.044 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.438 ' HG2' HD12 ' A' ' 28' ' ' LEU . 12.3 ttt180 -62.28 -32.36 73.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.775 0.321 . . . . 0.0 110.652 -179.852 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.567 ' HB1' HG21 ' A' ' 46' ' ' ILE . . . -104.8 20.15 19.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.58 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.0 p -73.64 -38.66 52.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.823 0.344 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.461 ' HG3' ' HZ1' ' A' ' 60' ' ' LYS . 19.2 tt0 -60.29 -53.35 65.71 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.591 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.45 ' O ' HD12 ' A' ' 61' ' ' LEU . 69.7 Cg_exo -38.91 -53.16 2.01 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.494 2.129 . . . . 0.0 112.635 179.702 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.544 ' HB3' HD23 ' A' ' 77' ' ' LEU . 11.6 mt -55.58 -48.29 75.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.5 -179.503 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 35.8 mm -58.03 -54.61 29.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.657 -179.46 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.461 ' HZ1' ' HG3' ' A' ' 56' ' ' GLU . 43.8 mmtm -69.81 -11.96 61.26 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.534 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.624 ' HG ' HG11 ' A' ' 69' ' ' VAL . 0.4 OUTLIER -87.46 -47.16 8.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.843 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.432 HD23 HD23 ' A' ' 92' ' ' LEU . 5.6 mt -56.24 -16.91 6.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.12 0.486 . . . . 0.0 110.846 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.06 -12.81 14.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.319 179.951 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.403 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.6 t0 -61.13 -35.52 77.28 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.18 0.514 . . . . 0.0 110.911 -179.958 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.547 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 42.9 m-20 52.59 29.95 7.93 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.747 179.792 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.444 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 43.9 t -84.36 -3.62 58.4 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.82 0.343 . . . . 0.0 111.028 179.892 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.88 -90.64 1.46 Allowed Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.434 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.79 -45.68 89.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.162 0.506 . . . . 0.0 109.801 179.435 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.624 HG11 ' HG ' ' A' ' 61' ' ' LEU . 21.3 t -69.19 -42.52 81.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.379 -179.873 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.547 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 0.9 OUTLIER -66.83 -62.84 1.24 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.023 -179.816 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.419 ' HA ' HH21 ' A' ' 70' ' ' ARG . 95.2 p -54.67 -24.94 23.97 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.005 179.715 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.58 -35.19 79.47 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.601 -179.915 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.424 ' O ' HD21 ' A' ' 77' ' ' LEU . . . -73.66 -38.61 64.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.556 0.217 . . . . 0.0 111.073 179.79 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HB2' HH22 ' A' ' 70' ' ' ARG . . . -42.49 -42.06 3.17 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.027 -179.04 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -84.14 -31.23 25.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.285 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.584 ' HA ' HE21 ' A' ' 79' ' ' GLN . 67.7 m -63.06 -46.3 88.14 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.743 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.621 ' HB3' HG13 ' A' ' 85' ' ' VAL . 3.8 mm? -55.34 -60.93 2.72 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.73 0.3 . . . . 0.0 111.534 -178.909 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -61.25 -27.04 68.17 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.758 0.313 . . . . 0.0 111.459 179.807 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.584 HE21 ' HA ' ' A' ' 76' ' ' SER . 5.0 mt-30 -70.55 -24.57 62.82 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.174 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.539 ' HB ' HG21 ' A' ' 85' ' ' VAL . 85.0 mt -74.86 -60.99 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.141 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 179.55 -135.68 2.58 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 119.911 -1.137 . . . . 0.0 113.711 -179.49 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.556 ' H ' HH11 ' A' ' 84' ' ' ARG . . . -127.51 -78.89 0.27 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 121.151 -0.547 . . . . 0.0 112.508 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -58.67 -21.27 53.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.82 0.343 . . . . 0.0 111.766 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.556 HH11 ' H ' ' A' ' 82' ' ' GLY . 4.3 mpt_? -75.97 -62.88 1.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.243 0.544 . . . . 0.0 110.28 -178.715 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.621 HG13 ' HB3' ' A' ' 77' ' ' LEU . 39.4 t -70.72 -20.43 22.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.988 179.653 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 23.3 ttm180 -46.47 -26.71 0.91 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.746 -179.939 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.5 -36.3 22.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.778 179.794 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.91 -44.26 77.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.36 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.533 ' HE3' ' HB1' ' A' ' 104' ' ' ALA . 4.3 ppp? -64.3 -28.69 69.89 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.912 0.387 . . . . 0.0 110.049 179.88 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.418 ' N ' ' SD ' ' A' ' 89' ' ' MET . 22.5 mt-10 -70.42 -37.6 74.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.636 179.015 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.459 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 7.3 tmtm? -66.68 -33.83 76.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.393 179.358 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.432 HD23 HD23 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -85.84 -27.37 25.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.931 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.28 -30.37 69.41 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.456 179.064 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -80.18 -25.07 39.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.358 179.934 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 61.8 p -110.96 20.89 17.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.14 179.067 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.57 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -51.34 119.19 7.74 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.701 -178.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.1 m -152.67 130.27 11.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.545 -0.328 . . . . 0.0 110.503 179.189 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.46 -144.61 49.34 Favored Glycine 0 CA--C 1.518 0.275 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.481 -179.839 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -68.71 -29.33 67.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.81 0.338 . . . . 0.0 110.839 179.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.525 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -50.13 -41.73 49.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.519 -179.911 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.57 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 74.7 ttt180 -67.79 -54.49 18.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.524 -179.549 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -45.79 -28.51 1.08 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.281 -179.771 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.525 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 53.6 t -61.8 -60.19 3.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.057 179.242 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.533 ' HB1' ' HE3' ' A' ' 89' ' ' MET . . . -53.54 -62.02 1.93 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.274 0.559 . . . . 0.0 111.776 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.446 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 46.3 t -54.41 -59.22 2.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.843 -178.643 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -56.84 -32.26 65.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.717 0.294 . . . . 0.0 111.612 -179.17 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.427 ' OH ' ' HA2' ' A' ' 82' ' ' GLY . 3.9 t80 -59.34 -27.88 66.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.047 0.451 . . . . 0.0 110.453 -179.678 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.484 ' HG ' ' HE2' ' A' ' 89' ' ' MET . 41.8 mt -56.48 -22.25 31.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.398 179.884 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -56.04 -17.83 7.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.475 -179.887 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.1 p -93.7 -64.63 1.06 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.975 179.723 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.434 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 80.0 m80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.323 -0.846 . . . . 0.0 110.718 179.903 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ttt . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.862 0.363 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.3 -24.35 67.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.833 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -109.45 10.13 25.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.732 179.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.428 ' O ' ' HB3' ' A' ' 5' ' ' ASN . 9.9 tp10 61.99 99.69 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.101 179.961 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.428 ' HB3' ' O ' ' A' ' 4' ' ' GLU . 51.2 t30 74.54 -46.08 0.6 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.623 179.902 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.0 tttt 60.06 -92.7 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.637 0.256 . . . . 0.0 111.016 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.48 ' CD1' HG22 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -79.1 -157.87 0.13 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.714 179.717 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.48 HG22 ' CD1' ' A' ' 7' ' ' TRP . 17.0 t 74.59 -7.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 120.807 0.337 . . . . 0.0 111.044 -179.641 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -116.97 -28.77 6.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.051 179.759 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.48 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 39.2 ptt180 -55.31 124.72 17.99 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.071 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 8.0 m-20 75.38 -25.7 0.2 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.674 -179.769 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.526 HG11 ' H ' ' A' ' 13' ' ' SER . 1.8 t -80.86 -143.5 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.569 -179.898 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.526 ' H ' HG11 ' A' ' 12' ' ' VAL . 17.5 p 62.98 20.04 12.02 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.762 0.315 . . . . 0.0 110.959 -179.858 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.437 ' HA ' ' N ' ' A' ' 19' ' ' MET . 1.7 t -174.26 98.59 0.1 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.166 179.621 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.641 ' H ' ' H ' ' A' ' 20' ' ' GLY . . . -95.94 -73.1 0.6 Allowed 'General case' 0 C--O 1.231 0.111 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.851 -179.712 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.448 HD12 ' N ' ' A' ' 17' ' ' SER . 0.5 OUTLIER -89.9 -67.49 0.84 Allowed 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.681 178.945 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.448 ' N ' HD12 ' A' ' 16' ' ' LEU . 69.5 p -91.85 -52.56 4.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.307 0.575 . . . . 0.0 110.15 178.316 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 171.97 53.75 0.0 OUTLIER 'General case' 0 C--O 1.232 0.162 0 CA-C-N 114.557 -1.201 . . . . 0.0 109.486 -179.494 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.478 ' SD ' ' HB2' ' A' ' 23' ' ' ALA . 19.8 mtp -109.43 -44.52 3.88 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.18 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.641 ' H ' ' H ' ' A' ' 15' ' ' ALA . . . 93.31 -139.66 14.69 Favored Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.83 -179.928 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -57.91 -28.1 63.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.762 0.315 . . . . 0.0 111.37 -179.751 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -61.96 -30.2 70.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.128 -179.874 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.544 ' HB1' ' HB3' ' A' ' 15' ' ' ALA . . . -104.73 19.11 21.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.653 -179.692 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.442 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -58.0 -51.77 68.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 179.698 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.39 -54.02 47.71 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.725 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.462 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 89.5 Cg_exo -40.1 -35.94 1.34 Allowed 'Trans proline' 0 C--N 1.362 1.272 0 C-N-CA 122.177 1.918 . . . . 0.0 111.433 -179.955 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 27.1 mt -66.86 -53.91 27.65 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.985 178.501 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.436 ' HA ' HD12 ' A' ' 31' ' ' LEU . 35.5 tp -61.65 -19.95 62.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.823 179.34 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -75.73 -43.25 47.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.21 -179.614 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.7 m -65.98 -14.37 61.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.363 -179.689 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.513 HD13 HG13 ' A' ' 46' ' ' ILE . 65.9 mt -70.33 -10.43 58.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.271 -179.918 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.6 p -101.79 10.32 40.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.701 179.795 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -81.65 145.76 30.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.76 -18.13 64.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.893 -179.957 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -77.71 142.15 38.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.921 -179.947 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 12.3 p90 -96.59 -22.2 17.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.148 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -72.2 -37.72 69.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.018 0.437 . . . . 0.0 110.693 -179.981 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.513 ' N ' HD13 ' A' ' 38' ' ' ILE . 1.8 mp -81.66 -36.13 14.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.736 -179.766 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.486 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 20.3 ttm180 -65.19 -25.51 67.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.489 -179.955 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.19 -64.59 3.05 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.509 -179.995 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.65 -39.48 24.38 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.661 0.267 . . . . 0.0 110.911 179.76 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.451 ' O ' HG12 ' A' ' 46' ' ' ILE . . . -57.25 -55.39 35.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.236 179.298 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.44 -33.93 71.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.255 179.209 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -64.97 -30.17 71.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.181 -179.814 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.438 ' O ' ' HB2' ' A' ' 48' ' ' ASN . 66.4 mt -98.73 -18.91 6.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.312 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.513 HG13 HD13 ' A' ' 31' ' ' LEU . 4.5 mm -50.41 -61.19 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.315 -179.234 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.673 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -68.56 -3.42 33.3 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.85 -0.691 . . . . 0.0 113.992 -178.395 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.579 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.8 OUTLIER -70.74 0.22 7.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 117.242 0.521 . . . . 0.0 111.078 -179.964 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -106.07 -23.01 12.73 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -179.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.592 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.6 OUTLIER 62.32 20.48 11.83 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.899 0.38 . . . . 0.0 110.946 -179.683 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -96.82 171.9 8.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.149 -179.874 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -66.41 -34.12 77.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.161 179.738 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -66.73 -13.23 61.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.963 0.411 . . . . 0.0 111.09 -179.719 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.456 ' HA ' HG22 ' A' ' 46' ' ' ILE . . . -101.68 6.38 41.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.928 -179.304 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.3 p -92.24 -39.11 11.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.553 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 35.7 tt0 -60.26 -51.9 76.98 Favored Pre-proline 0 CA--C 1.53 0.211 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -178.99 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.553 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 88.1 Cg_exo -47.07 -49.21 13.07 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 121.881 1.721 . . . . 0.0 111.615 179.507 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.506 ' HA ' ' HB2' ' A' ' 73' ' ' ALA . 10.3 mt -56.77 -37.37 70.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.376 -179.697 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.6 mm -61.89 -59.33 4.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.901 0.382 . . . . 0.0 111.985 -179.396 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.3 mmmt -70.02 -9.72 56.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.32 -178.873 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.601 ' HG ' HG13 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -87.46 -44.34 11.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -178.327 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.664 HD12 HD22 ' A' ' 92' ' ' LEU . 7.6 mt -59.19 -11.32 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.095 0.474 . . . . 0.0 110.641 -179.119 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -116.03 -14.84 11.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.153 -179.926 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -61.23 -22.95 65.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.248 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.57 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 4.0 p30 41.51 32.28 0.22 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.411 -0.813 . . . . 0.0 112.153 179.786 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.445 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 22.2 t -86.18 -8.73 57.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.195 -179.998 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.89 -86.03 1.09 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.248 -179.765 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.45 -42.95 99.56 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.103 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.601 HG13 ' HG ' ' A' ' 61' ' ' LEU . 4.2 t -68.69 -49.29 65.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.338 -179.766 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.57 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 51.5 ttp180 -62.7 -41.48 99.16 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.233 -179.758 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 80.5 p -64.26 -31.51 72.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.995 -179.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.21 -28.56 69.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.515 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.506 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . . . -74.3 -58.55 3.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.655 0.264 . . . . 0.0 111.588 -179.844 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -60.1 -23.93 64.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.833 -179.204 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.6 ttt-85 -81.39 -47.86 12.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.722 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.673 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 8.7 m -67.22 -30.13 69.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.754 -179.494 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 74' ' ' ALA . 18.3 mt -60.76 -59.81 4.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.833 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -54.45 -36.3 63.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.234 179.392 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.541 HE21 ' HA ' ' A' ' 76' ' ' SER . 47.6 mt-30 -58.93 -37.36 76.51 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.918 0.39 . . . . 0.0 110.913 179.718 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.592 HG12 ' HG3' ' A' ' 50' ' ' GLN . 98.3 mt -71.97 -60.32 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.924 179.856 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 67.96 123.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.632 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.565 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 142.93 175.51 16.11 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.68 179.873 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -65.85 -26.15 67.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.761 0.315 . . . . 0.0 111.11 -179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.565 HH11 ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -61.84 -54.31 43.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.665 -179.405 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.562 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 3.4 m -70.71 -23.8 24.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.84 0.352 . . . . 0.0 111.306 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.479 ' HA ' ' HG2' ' A' ' 89' ' ' MET . 68.5 ttt180 -58.64 -40.87 84.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.968 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.78 -33.45 70.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.738 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.22 -34.23 77.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.412 179.526 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.512 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 17.6 mmm -69.27 -55.44 10.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.042 -0.527 . . . . 0.0 109.981 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -54.03 -33.53 57.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.4 179.377 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -79.24 -22.84 44.22 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.683 179.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.704 HD21 ' HB3' ' A' ' 104' ' ' ALA . 1.8 tp -87.16 -30.67 20.87 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.707 179.858 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.77 -32.17 69.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.527 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.456 ' HG3' HG23 ' A' ' 95' ' ' THR . 12.9 pt-20 -80.39 -20.97 42.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.09 0.472 . . . . 0.0 110.15 179.853 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.456 HG23 ' HG3' ' A' ' 94' ' ' GLU . 45.1 p -119.23 28.8 8.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.677 179.015 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -52.66 120.98 13.16 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.222 -0.899 . . . . 0.0 113.75 -178.862 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.3 t -140.63 130.68 24.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.727 0.299 . . . . 0.0 110.334 178.895 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.46 -134.71 22.9 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.54 -0.838 . . . . 0.0 111.994 -179.463 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -93.85 -12.29 29.28 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.813 0.34 . . . . 0.0 110.541 179.698 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.568 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.8 -41.17 66.98 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.738 179.454 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -60.48 -56.64 18.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.051 179.86 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -48.56 -23.13 0.89 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.66 179.774 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.568 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 41.8 t -78.19 -55.83 9.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.646 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.704 ' HB3' HD21 ' A' ' 92' ' ' LEU . . . -52.93 -41.31 64.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.167 0.508 . . . . 0.0 112.206 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 85.2 t -64.89 -60.03 3.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.74 -178.318 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -65.54 -47.86 74.44 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.612 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.512 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 67.6 t80 -60.13 -22.63 63.08 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.666 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 4.6 mt -59.48 -20.83 58.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.602 -179.718 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -73.1 -9.7 59.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.338 -179.785 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 69.3 p -127.99 23.67 6.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.204 -179.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 26.4 m80 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.998 179.724 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.876 0.369 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.72 -22.94 67.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.429 -179.743 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -127.07 48.44 2.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.95 0.405 . . . . 0.0 110.822 -179.751 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 60.63 -85.59 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.333 179.896 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -145.13 112.04 5.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.776 0.322 . . . . 0.0 110.949 179.95 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.9 mmmt -137.92 9.3 2.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.047 179.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -162.66 107.5 1.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.987 0.422 . . . . 0.0 111.358 -179.97 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 8' ' ' VAL . 9.8 p -170.71 18.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.733 179.847 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -163.71 -31.76 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.964 -179.758 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.416 ' HA ' ' NE ' ' A' ' 10' ' ' ARG . 4.4 mmp_? -47.93 116.7 1.59 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.579 179.625 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.4 t70 77.52 -37.45 0.25 Allowed 'General case' 0 N--CA 1.464 0.259 0 O-C-N 123.656 0.598 . . . . 0.0 111.436 -179.936 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.489 HG13 ' HA ' ' A' ' 23' ' ' ALA . 94.8 t -64.2 135.49 27.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.052 0.453 . . . . 0.0 111.536 -179.621 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.4 t -159.58 -51.32 0.06 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.42 179.726 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.9 t -131.07 17.51 5.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.674 179.579 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -88.61 -1.56 58.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.982 179.825 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.436 ' CD1' ' N ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -48.15 -19.04 0.24 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.927 -179.911 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.432 ' H ' HD12 ' A' ' 16' ' ' LEU . 87.8 p -47.14 -39.43 13.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.473 179.997 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -178.69 89.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.304 -179.446 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -134.04 -43.62 0.8 Allowed 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.517 179.623 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.53 -134.66 6.96 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.739 -179.737 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -84.48 -28.45 26.76 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.852 0.358 . . . . 0.0 111.074 -179.804 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -58.87 -31.46 68.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.174 -179.811 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.489 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -105.47 6.03 32.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.738 -179.505 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.581 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 14.0 t80 -63.43 -44.84 93.43 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.46 ' HG3' ' NH1' ' A' ' 53' ' ' ARG . 3.2 mt-10 -53.39 -54.18 48.12 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.158 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.473 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 98.9 Cg_exo -43.11 -18.18 0.11 Allowed 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.719 2.279 . . . . 0.0 113.09 -179.998 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.8 mt -80.06 -58.15 3.29 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.323 179.724 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.6 -16.24 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.854 179.291 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -69.16 -30.96 69.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.621 178.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.4 t -66.45 -16.76 64.36 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.147 179.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.8 mt -62.42 -6.78 3.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.131 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.3 m -120.26 23.42 10.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.455 -179.566 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -90.15 150.52 21.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.33 -179.749 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -65.88 -35.17 79.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.031 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -75.96 156.48 34.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.206 -179.624 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -106.49 -33.94 7.54 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.098 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.459 ' HG3' HG13 ' A' ' 38' ' ' ILE . 33.2 ptt180 -59.79 -40.18 87.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.045 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.459 HG13 ' HG3' ' A' ' 37' ' ' ARG . 60.0 mt -77.69 -37.63 24.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.8 179.865 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -58.44 -22.96 56.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.379 179.416 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -78.88 -50.17 6.07 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.336 179.775 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.38 -34.25 23.5 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.836 0.35 . . . . 0.0 110.81 179.695 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.484 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -60.99 -55.14 36.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.202 179.291 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.19 -25.97 68.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.953 179.459 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.5 m95 -70.63 -37.43 73.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.234 -178.938 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.488 ' HA ' HD21 ' A' ' 48' ' ' ASN . 52.7 mt -99.17 -19.53 5.87 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-O 120.969 0.414 . . . . 0.0 111.755 -178.66 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.593 HG12 ' HA ' ' A' ' 54' ' ' ALA . 4.0 tt -56.82 -36.02 48.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.489 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.52 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -77.97 -22.15 69.45 Favored Glycine 0 CA--C 1.518 0.242 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.369 -178.996 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.488 HD21 ' HA ' ' A' ' 45' ' ' ILE . 36.2 m-80 -70.75 2.14 4.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.352 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.427 ' HB3' ' OD2' ' A' ' 51' ' ' ASP . 36.8 m-85 -107.97 -25.42 11.18 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.788 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.739 HE21 ' HA ' ' A' ' 80' ' ' ILE . 25.9 mp0 63.76 39.64 8.33 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.12 0.486 . . . . 0.0 110.942 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.427 ' OD2' ' HB3' ' A' ' 49' ' ' PHE . 2.8 m-20 -100.8 169.51 8.95 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.532 -179.499 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.481 ' O ' HG22 ' A' ' 55' ' ' VAL . 8.7 pt-20 -66.48 -40.39 89.3 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.423 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.46 ' NH1' ' HG3' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -69.34 -8.7 48.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.658 0.266 . . . . 0.0 110.741 179.806 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.593 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -87.84 -35.99 17.47 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.584 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.481 HG22 ' O ' ' A' ' 52' ' ' GLU . 35.1 m -64.5 -39.57 86.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -178.003 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.631 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 3.6 tp10 -59.44 -54.2 58.37 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -178.641 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.631 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 80.1 Cg_exo -46.34 -52.11 7.76 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.297 1.998 . . . . 0.0 112.476 179.62 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 73' ' ' ALA . 12.3 mt -53.65 -29.03 36.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.915 -179.14 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.0 mm -63.43 -60.73 2.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.43 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -70.1 -10.58 59.2 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -178.969 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.561 ' HG ' HG11 ' A' ' 69' ' ' VAL . 0.6 OUTLIER -83.02 -49.59 9.4 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.481 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.525 HD12 HD11 ' A' ' 77' ' ' LEU . 12.7 mt -56.39 -9.92 0.81 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.494 -179.311 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -123.78 -8.53 7.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.034 179.593 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -61.11 -38.83 87.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.074 0.464 . . . . 0.0 111.275 179.985 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.512 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 49.7 m-20 64.14 24.7 13.52 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.257 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.465 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.0 OUTLIER -83.91 7.64 17.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.291 -179.974 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.6 -78.32 0.73 Allowed Glycine 0 C--N 1.33 0.196 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.492 179.946 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -51.07 66.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.286 0.565 . . . . 0.0 109.969 179.422 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.561 HG11 ' HG ' ' A' ' 61' ' ' LEU . 21.8 t -62.63 -43.76 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.379 -179.8 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.512 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 37.8 ttp180 -66.77 -60.12 2.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.238 -179.686 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.0 m -51.51 -28.02 12.34 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.174 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -60.98 -46.01 95.44 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.184 179.702 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.507 ' HA ' HD23 ' A' ' 58' ' ' LEU . . . -66.96 -35.89 80.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.764 0.316 . . . . 0.0 111.085 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.17 -46.98 72.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.453 -179.691 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -78.88 -36.3 42.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.448 -179.688 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.52 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 58.8 m -59.37 -41.98 90.55 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.409 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.525 HD11 HD12 ' A' ' 62' ' ' LEU . 11.5 mt -61.1 -60.82 3.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.768 0.318 . . . . 0.0 110.718 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HA ' ' CD1' ' A' ' 107' ' ' TYR . 34.0 mt-10 -53.77 -33.24 55.22 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.557 178.726 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -63.2 -42.48 99.33 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.853 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.739 ' HA ' HE21 ' A' ' 50' ' ' GLN . 91.7 mt -64.32 -60.39 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.21 179.117 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.59 133.32 0.05 OUTLIER Glycine 0 CA--C 1.518 0.251 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.881 179.782 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 133.39 164.36 10.76 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.586 179.822 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.19 -22.43 66.9 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.782 0.325 . . . . 0.0 110.738 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.64 ' HD3' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -60.57 -53.42 57.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 -179.998 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.64 ' N ' ' HD3' ' A' ' 84' ' ' ARG . 2.3 t -70.81 -26.14 27.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.053 0.454 . . . . 0.0 110.245 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.492 ' HD2' ' HD1' ' A' ' 111' ' ' HIS . 74.2 ttt180 -52.44 -31.9 36.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.756 -179.84 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.11 92.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.393 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.09 -35.94 78.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.219 179.34 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.645 ' HE1' ' HA ' ' A' ' 104' ' ' ALA . 8.2 mmm -67.8 -43.08 80.51 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.568 179.05 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 14.4 mm-40 -57.39 -36.4 71.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.724 178.494 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -75.89 -28.74 58.23 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.29 179.771 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.435 HD22 HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -87.16 -23.24 24.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.935 0.398 . . . . 0.0 110.428 179.817 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.15 -29.88 70.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.382 -179.843 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.498 ' HG3' HG22 ' A' ' 95' ' ' THR . 11.3 pt-20 -80.22 -23.23 41.04 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.975 0.417 . . . . 0.0 110.291 179.741 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.498 HG22 ' HG3' ' A' ' 94' ' ' GLU . 73.9 p -111.87 19.63 17.75 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.794 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.579 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -52.18 119.67 9.55 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 114.952 -1.022 . . . . 0.0 113.306 -179.201 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.3 t -144.1 130.35 19.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.813 0.339 . . . . 0.0 111.007 179.205 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.63 -131.01 50.74 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.902 179.936 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -77.36 -27.76 52.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.722 0.296 . . . . 0.0 111.278 -179.792 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.43 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -53.93 -31.42 50.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.68 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.579 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 47.8 ttt180 -75.31 -52.46 10.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.373 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -48.22 -22.0 0.59 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.268 0.556 . . . . 0.0 110.454 179.651 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.493 HG13 ' HE3' ' A' ' 89' ' ' MET . 49.1 t -69.05 -60.17 2.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.524 179.738 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.645 ' HA ' ' HE1' ' A' ' 89' ' ' MET . . . -58.23 -46.97 84.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.179 0.514 . . . . 0.0 112.227 -179.596 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.403 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 59.5 t -64.88 -63.15 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -178.069 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -55.42 -37.3 67.48 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.199 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.56 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 22.9 t80 -61.5 -23.76 66.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.975 0.417 . . . . 0.0 111.421 -178.705 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 74.5 mt -58.1 -25.47 61.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.661 -179.478 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -85.38 0.45 52.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.522 -179.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 47.3 p -145.54 29.27 1.14 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -179.585 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.492 ' HD1' ' HD2' ' A' ' 86' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.153 -0.927 . . . . 0.0 111.043 179.927 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.8 tpt . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.8 0.333 . . . . 0.0 110.794 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -113.88 1.59 14.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.288 -179.911 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -109.99 -62.72 1.47 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.821 179.901 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.16 150.39 48.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.791 179.895 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.42 ' ND2' HG12 ' A' ' 8' ' ' VAL . 43.3 t30 59.34 93.84 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.311 179.932 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -98.08 -32.89 11.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.882 179.934 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 58.4 m95 -75.61 83.67 2.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.669 179.915 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.613 ' HA ' ' HB2' ' A' ' 22' ' ' GLU . 1.6 p -177.41 -53.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.643 -179.613 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.421 ' H ' HG13 ' A' ' 8' ' ' VAL . 0.0 OUTLIER -107.85 21.74 16.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.172 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptp180 -59.95 108.7 0.8 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.998 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.2 t70 73.05 -0.85 3.24 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.333 -178.98 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.708 HG12 ' H ' ' A' ' 13' ' ' SER . 1.5 t -108.91 -165.91 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.207 179.743 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.708 ' H ' HG12 ' A' ' 12' ' ' VAL . 42.9 t -156.82 -69.65 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.739 0.304 . . . . 0.0 110.52 179.916 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.4 p -75.28 90.62 2.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.975 0.417 . . . . 0.0 110.253 179.32 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.641 ' HA ' ' HG3' ' A' ' 19' ' ' MET . . . -85.86 -60.75 1.92 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.063 -178.969 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.41 HD23 ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -55.66 -13.85 1.87 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.88 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.481 ' O ' ' HB2' ' A' ' 18' ' ' ARG . 38.7 t -61.84 -52.75 62.87 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 121.115 -0.234 . . . . 0.0 111.111 -179.679 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.481 ' HB2' ' O ' ' A' ' 17' ' ' SER . 63.0 ttt180 169.65 92.32 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 O-C-N 123.574 0.546 . . . . 0.0 110.235 179.939 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.641 ' HG3' ' HA ' ' A' ' 15' ' ' ALA . 1.9 mmt -133.22 -28.22 1.52 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.077 -179.531 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.33 139.25 0.69 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.098 -179.515 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 66.68 -77.36 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.201 0.524 . . . . 0.0 110.751 -179.483 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.613 ' HB2' ' HA ' ' A' ' 8' ' ' VAL . 10.4 pt-20 -57.78 -32.62 67.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.156 179.834 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.628 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -87.94 -6.72 57.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.849 -179.221 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.531 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.9 t80 -59.14 -56.21 25.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.698 -179.693 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.439 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.41 -51.26 69.08 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-O 119.216 -0.421 . . . . 0.0 111.724 179.979 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.628 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 59.8 Cg_exo -39.23 -29.65 0.22 Allowed 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 122.285 1.99 . . . . 0.0 111.254 179.174 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.9 mt -73.85 -55.18 6.52 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.726 -1.124 . . . . 0.0 109.339 177.882 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.547 HD21 HD12 ' A' ' 31' ' ' LEU . 3.0 tm? -53.33 -46.52 69.5 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.844 178.538 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -62.72 -41.87 99.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.738 179.931 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.533 ' HA ' ' HB2' ' A' ' 33' ' ' ASN . 47.4 t -66.37 -12.27 55.91 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.061 -179.278 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.547 HD12 HD21 ' A' ' 28' ' ' LEU . 49.0 mt -57.44 -24.3 54.78 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.915 0.388 . . . . 0.0 110.688 -179.774 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 71.3 p -125.8 21.81 7.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.628 179.723 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.533 ' HB2' ' HA ' ' A' ' 30' ' ' SER . 26.3 t-20 -57.36 141.22 47.86 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.074 -179.747 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.25 -43.51 96.07 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.731 -179.948 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -77.95 137.64 38.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.593 179.526 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 21.3 m95 -76.86 -29.79 56.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.146 -179.661 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -62.97 -45.29 93.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.875 179.902 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.6 mm -67.37 -36.06 75.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.766 179.771 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.63 HH12 HD21 ' A' ' 61' ' ' LEU . 1.3 tpm_? -64.9 -34.52 78.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.636 179.738 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.17 -64.46 2.99 Favored Glycine 0 C--N 1.33 0.204 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.751 -179.873 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.32 -33.91 9.68 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.732 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.623 ' HB2' HH21 ' A' ' 39' ' ' ARG . . . -63.64 -56.35 16.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.78 0.324 . . . . 0.0 110.782 179.967 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.405 ' HB3' HD21 ' A' ' 61' ' ' LEU . . . -62.27 -26.05 68.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.077 179.539 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.9 m95 -70.55 -39.72 73.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.526 -178.762 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.8 mt -98.88 -19.08 6.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.842 0.353 . . . . 0.0 111.868 -178.515 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.516 HD12 ' HG2' ' A' ' 57' ' ' PRO . 5.4 tt -53.9 -36.44 30.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.044 -178.996 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.27 -17.58 74.27 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.179 -179.551 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.549 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.9 OUTLIER -70.33 -7.26 41.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.703 0.251 . . . . 0.0 111.58 -179.486 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -94.15 -24.92 17.34 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.598 0.237 . . . . 0.0 111.476 -179.905 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.625 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.7 mp0 60.74 30.28 19.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.382 179.485 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.438 ' O ' HG22 ' A' ' 55' ' ' VAL . 11.2 t70 -102.67 162.27 13.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.733 179.844 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -61.35 -36.23 79.63 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.011 -179.829 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 35.0 ttm180 -67.33 -9.61 42.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.026 0.441 . . . . 0.0 110.457 179.634 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.92 -7.99 21.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.558 -179.795 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 51' ' ' ASP . 21.4 t -90.22 -35.2 7.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.005 -179.769 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.509 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 20.6 tt0 -60.16 -48.44 94.31 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.341 -179.926 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.516 ' HG2' HD12 ' A' ' 46' ' ' ILE . 83.7 Cg_exo -46.18 -48.44 13.04 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 122.341 2.027 . . . . 0.0 112.094 179.365 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.502 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 1.7 mt -56.04 -33.06 64.62 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.8 -179.468 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 39.8 mm -57.16 -60.8 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.066 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.442 ' HZ1' ' HA ' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -70.24 -38.29 75.16 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.974 0.416 . . . . 0.0 111.826 -179.488 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.63 HD21 HH12 ' A' ' 39' ' ' ARG . 1.6 mp -57.08 -49.37 76.07 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -178.389 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.548 ' HB3' HD23 ' A' ' 92' ' ' LEU . 34.5 mt -60.44 -9.58 3.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.272 0.558 . . . . 0.0 110.008 -179.672 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -117.58 -12.0 10.39 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.843 179.511 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.47 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 6.5 t70 -61.05 -48.37 82.06 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.233 0.54 . . . . 0.0 111.152 -179.499 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.479 ' HB2' ' NH2' ' A' ' 70' ' ' ARG . 20.3 t70 68.98 21.39 7.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.806 179.447 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.455 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 36.2 m -86.22 12.14 10.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.265 -179.785 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.3 -100.78 1.42 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.614 179.712 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -46.27 -36.61 6.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.155 0.502 . . . . 0.0 110.512 179.762 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.573 HG12 ' HG ' ' A' ' 61' ' ' LEU . 16.4 t -73.57 -47.23 45.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.989 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.479 ' NH2' ' HB2' ' A' ' 65' ' ' ASP . 14.0 ttm180 -71.75 -61.76 1.66 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.651 0.263 . . . . 0.0 111.542 -179.48 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 87.6 p -50.56 -31.16 14.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.341 -179.706 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -62.66 -39.42 97.9 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.734 179.919 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.502 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -73.49 -30.03 62.89 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.599 0.238 . . . . 0.0 111.363 -179.983 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.8 -46.22 74.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.643 -179.591 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.1 ptp180 -79.28 -17.09 55.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.384 -179.716 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.0 t -63.82 -44.34 93.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.285 179.778 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.426 ' HA ' HG13 ' A' ' 85' ' ' VAL . 6.4 mp -58.95 -60.26 4.15 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.77 0.319 . . . . 0.0 111.138 179.997 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -50.92 -39.17 53.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.151 179.651 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -55.98 -38.37 70.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.339 -179.876 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.625 HG12 ' HG3' ' A' ' 50' ' ' GLN . 61.2 mt -86.95 -60.63 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.425 -179.767 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.82 93.81 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.512 -179.858 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.469 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 179.48 -174.16 45.96 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.779 -179.888 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -67.81 -31.93 72.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.891 0.376 . . . . 0.0 111.202 -179.7 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.56 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -60.44 -56.22 24.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.088 -179.814 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.56 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.6 OUTLIER -70.83 -20.69 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.839 0.352 . . . . 0.0 110.889 179.488 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.459 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 2.2 tmt_? -55.81 -31.98 63.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.801 179.404 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.412 ' O ' ' HG3' ' A' ' 90' ' ' GLU . . . -76.99 -23.94 52.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.865 179.801 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.24 -44.68 64.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.749 179.676 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.529 ' SD ' ' N ' ' A' ' 90' ' ' GLU . 2.3 ppp? -71.93 -30.58 65.48 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.276 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.529 ' N ' ' SD ' ' A' ' 89' ' ' MET . 1.0 OUTLIER -75.91 -29.19 58.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.936 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -72.05 -30.62 65.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.907 178.851 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.548 HD23 ' HB3' ' A' ' 62' ' ' LEU . 0.4 OUTLIER -87.33 -31.8 19.98 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.285 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.49 -24.98 61.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.408 178.807 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.21 -26.58 39.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.12 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 68.0 p -121.54 27.6 8.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.43 179.024 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -54.09 125.12 32.51 Favored Glycine 0 N--CA 1.448 -0.539 0 CA-C-N 115.086 -0.961 . . . . 0.0 113.683 -178.822 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.1 t -150.25 130.34 13.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.897 0.379 . . . . 0.0 111.033 179.129 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.22 -146.92 42.71 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.895 179.895 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.13 -28.71 62.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.672 0.272 . . . . 0.0 111.404 -179.805 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.527 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -55.25 -53.84 50.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.704 -179.79 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 39.4 ttp180 -55.24 -61.04 2.59 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.249 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 23.5 ttpp -45.67 -30.59 1.6 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.484 -179.174 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.527 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 4.8 t -65.06 -59.08 4.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.715 -179.82 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.39 -60.4 3.18 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.293 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 92.2 t -57.96 -61.24 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.447 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 12.0 m120 -55.49 -29.73 59.34 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.804 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -60.28 -33.07 71.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.135 0.493 . . . . 0.0 110.499 -179.899 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.42 ' HA ' ' HD1' ' A' ' 111' ' ' HIS . 74.5 mt -55.24 -13.43 1.31 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.865 -179.419 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.463 ' HG3' HG22 ' A' ' 110' ' ' THR . 9.0 pt-20 -78.42 5.22 11.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.553 -179.998 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 110' ' ' THR . . . . . 0.463 HG22 ' HG3' ' A' ' 109' ' ' GLU . 70.0 p -144.98 7.06 1.19 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.436 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.42 ' HD1' ' HA ' ' A' ' 108' ' ' LEU . 18.2 p-80 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.824 -179.993 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.737 0.303 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.16 -31.5 0.2 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.248 -179.905 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -145.01 7.63 1.21 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 -179.872 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -115.24 -67.27 1.01 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.821 179.945 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -97.4 102.67 14.48 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.734 179.75 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -135.12 -171.51 2.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.176 179.976 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 2.0 p90 32.49 87.73 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.554 0.534 . . . . 0.0 112.193 179.543 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.7 p -152.32 130.47 2.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.364 179.927 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 63.96 4.36 1.97 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.956 179.635 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.423 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 32.9 ptt180 -72.25 116.45 12.7 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.163 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.423 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 25.6 t70 77.03 -49.69 0.55 Allowed 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.995 -179.282 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.582 HG11 ' H ' ' A' ' 13' ' ' SER . 2.4 t -68.32 176.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.546 179.878 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.582 ' H ' HG11 ' A' ' 12' ' ' VAL . 78.6 p -156.84 -3.27 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.707 0.289 . . . . 0.0 110.963 179.893 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.613 ' HB ' ' HB3' ' A' ' 17' ' ' SER . 1.5 m -85.93 166.62 15.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.282 179.435 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.438 ' H ' HG23 ' A' ' 14' ' ' THR . . . -95.3 -67.85 0.83 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.402 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.5 mt -83.5 -13.96 53.45 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.079 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.613 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 43.6 t -58.78 -52.06 67.3 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.593 -179.257 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -177.42 117.57 0.1 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.792 0.329 . . . . 0.0 111.379 -179.528 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.554 ' HA ' ' HE2' ' A' ' 19' ' ' MET . 14.8 mmt -122.0 -13.0 8.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.438 179.177 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.77 -17.07 47.6 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.835 179.727 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -174.23 -41.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.835 0.35 . . . . 0.0 111.02 -179.766 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.48 ' HB3' ' HB3' ' A' ' 19' ' ' MET . 30.5 tt0 -62.77 -29.66 70.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.487 -179.592 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.503 ' H ' ' HB2' ' A' ' 19' ' ' MET . . . -100.68 -3.75 29.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.67 -179.614 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.09 -52.95 62.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 110.316 179.449 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -63.37 -54.98 39.56 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.19 179.703 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.42 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 43.7 Cg_exo -51.74 -19.49 7.94 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.754 1.636 . . . . 0.0 110.758 179.733 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.629 HD21 ' HA ' ' A' ' 46' ' ' ILE . 1.4 tp -87.05 -36.06 18.39 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.416 179.809 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.594 HD13 HD11 ' A' ' 31' ' ' LEU . 21.1 tp -81.94 -22.48 36.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.338 -179.942 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.91 -32.25 61.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.864 0.364 . . . . 0.0 110.998 -179.407 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 93.7 p -66.44 -20.05 65.95 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.41 -179.872 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.594 HD11 HD13 ' A' ' 28' ' ' LEU . 81.4 mt -66.19 -7.83 20.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.263 -179.824 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 98.2 p -106.91 21.82 16.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.826 179.769 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -84.7 142.99 29.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.08 -179.918 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -67.19 -17.53 64.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.597 179.746 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -86.36 156.63 20.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.659 179.835 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.9 p-90 -100.66 -34.29 9.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.427 -179.53 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -64.82 -44.74 88.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.774 0.321 . . . . 0.0 111.098 -179.901 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.4 mt -63.8 -42.92 97.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.717 -179.896 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -63.99 -21.63 66.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.553 179.765 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.12 -61.09 7.01 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.508 179.856 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.75 -34.77 28.49 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.737 0.303 . . . . 0.0 111.211 179.832 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.5 -56.72 18.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.709 179.729 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.37 -32.69 72.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.56 179.426 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.8 m95 -70.7 -29.33 65.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.466 -179.313 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.1 mt -99.02 -25.04 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-O 120.931 0.395 . . . . 0.0 111.574 -179.06 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.629 ' HA ' HD21 ' A' ' 27' ' ' LEU . 2.8 tt -60.55 -28.13 41.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.502 -178.792 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.533 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -66.23 -26.1 72.48 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.489 179.777 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.547 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.8 OUTLIER -53.14 -39.65 63.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.398 . . . . 0.0 110.159 179.615 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.414 ' C ' ' H ' ' A' ' 51' ' ' ASP . 24.8 m-85 -87.54 119.58 27.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.275 179.203 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.423 ' HG2' HG21 ' A' ' 80' ' ' ILE . 51.8 mt-30 -81.79 24.99 0.57 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.674 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.414 ' H ' ' C ' ' A' ' 49' ' ' PHE . 6.6 m-20 -83.94 163.09 20.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.096 -179.8 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.45 -25.97 66.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.183 -179.805 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.422 ' HD3' HD21 ' A' ' 28' ' ' LEU . 18.7 ttm180 -68.12 -12.81 61.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.759 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.57 -4.47 21.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 -179.374 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.5 t -83.76 -40.09 15.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.916 -179.091 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.475 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 2.1 tm-20 -60.21 -49.61 89.93 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 -179.643 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.475 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 92.8 Cg_exo -43.72 -52.3 5.45 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 122.244 1.963 . . . . 0.0 112.083 179.229 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 24.5 mt -49.82 -37.14 29.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.394 -0.821 . . . . 0.0 112.197 -179.81 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 44.7 mm -61.0 -62.09 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.07 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.423 ' HG3' HD13 ' A' ' 61' ' ' LEU . 5.3 pttt -72.71 -6.58 45.5 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.934 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.642 ' HG ' HG13 ' A' ' 69' ' ' VAL . 1.5 mp -89.03 -46.45 8.85 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -178.322 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.479 HD13 HD23 ' A' ' 92' ' ' LEU . 10.0 mt -60.76 -10.01 4.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.14 0.495 . . . . 0.0 110.377 -179.277 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -115.46 -14.98 11.54 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.146 -179.655 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -61.13 -31.59 71.3 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.124 0.488 . . . . 0.0 111.284 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.488 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 55.6 m-20 51.58 28.08 4.4 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.039 179.912 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.462 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 33.0 t -86.33 7.13 26.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.683 0.278 . . . . 0.0 111.27 179.903 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.59 -96.02 1.73 Allowed Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.296 -179.89 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -50.33 -43.63 54.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.128 0.49 . . . . 0.0 110.15 179.524 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.642 HG13 ' HG ' ' A' ' 61' ' ' LEU . 11.8 t -73.62 -46.23 48.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.864 -179.806 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.488 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 4.3 tmm_? -66.09 -64.03 0.95 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.549 -179.091 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.9 m -54.39 -27.1 34.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.608 179.827 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.6 -46.46 88.57 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.64 -0.79 . . . . 0.0 111.936 179.57 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.408 ' HB1' ' HB3' ' A' ' 61' ' ' LEU . . . -59.19 -56.09 26.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.581 0.229 . . . . 0.0 111.14 179.774 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -51.79 -27.0 10.87 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.07 0.462 . . . . 0.0 110.883 -179.562 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 34.8 ttt85 -80.31 -40.04 27.54 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.916 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.533 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 0.0 OUTLIER -67.08 -35.24 79.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.2 -178.966 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.5 mp -56.68 -59.06 5.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.654 0.264 . . . . 0.0 111.092 -179.663 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.43 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 44.7 mt-10 -49.0 -27.15 2.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.804 179.817 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -70.73 -43.61 68.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.779 0.323 . . . . 0.0 111.501 -179.86 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.423 HG21 ' HG2' ' A' ' 50' ' ' GLN . 46.7 mt -70.06 -61.28 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.8 -179.12 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 53.14 89.52 0.01 OUTLIER Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.498 -179.716 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.422 ' H ' ' CG1' ' A' ' 85' ' ' VAL . . . 178.33 -173.45 45.88 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.607 -179.623 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 86' ' ' ARG . 4.9 tm-20 -72.24 -25.8 61.77 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.781 0.324 . . . . 0.0 111.181 -179.691 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.563 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -70.0 -50.72 38.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.984 0.421 . . . . 0.0 110.499 179.839 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.563 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 11.5 p -70.66 -25.69 26.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.434 179.132 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.581 ' NH2' ' HA ' ' A' ' 108' ' ' LEU . 1.1 mmp_? -47.12 -40.08 14.74 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.152 179.635 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.11 -30.92 71.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.443 -179.389 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.36 -55.42 33.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.81 -179.796 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.549 ' HE1' ' HB3' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -68.3 -25.86 65.35 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.198 -179.389 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 42.5 mt-10 -73.02 -34.37 66.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.97 0.414 . . . . 0.0 109.995 179.133 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -78.92 -24.9 43.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.427 179.111 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.479 HD23 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -87.63 -30.19 20.64 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.203 179.323 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.27 -29.97 67.96 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.147 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.07 -26.57 39.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.15 0.5 . . . . 0.0 109.692 179.339 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.8 p -107.59 21.24 17.75 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.608 178.524 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.617 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -46.48 108.53 0.27 Allowed Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.124 -0.943 . . . . 0.0 112.751 -179.431 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 33.1 p -139.75 129.36 24.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.732 0.301 . . . . 0.0 110.727 -179.882 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 55.38 -145.02 32.11 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.858 -179.879 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -58.92 -30.46 67.86 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.715 0.293 . . . . 0.0 111.161 179.975 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.515 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -52.19 -42.59 63.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.852 -179.615 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.617 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 43.2 ttt180 -66.5 -55.6 14.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.676 0.274 . . . . 0.0 111.623 -179.535 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.2 tptp -46.05 -25.13 0.52 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.593 179.915 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.515 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 21.3 t -71.83 -58.43 5.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.912 -179.868 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.492 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -51.35 -60.88 2.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.819 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.523 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 21.8 t -56.58 -47.9 81.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -178.04 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -71.01 -35.01 71.89 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -179.52 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.43 ' CE1' ' HA ' ' A' ' 78' ' ' GLU . 14.1 t80 -64.11 -46.96 81.91 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.292 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.581 ' HA ' ' NH2' ' A' ' 86' ' ' ARG . 3.0 pp -55.34 -10.85 0.66 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.187 -178.882 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -89.11 6.96 37.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.52 0.2 . . . . 0.0 111.467 179.735 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.5 p -129.81 -66.54 0.79 Allowed 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.792 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.511 ' HB3' HH22 ' A' ' 86' ' ' ARG . 21.4 p80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 117.949 -1.024 . . . . 0.0 111.331 -179.266 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.4 mmt . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 120.908 0.385 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.02 117.49 19.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.229 179.968 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.3 t70 61.79 105.58 0.02 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.162 -179.932 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.422 ' HG2' ' N ' ' A' ' 5' ' ' ASN . 35.6 tt0 63.34 162.16 0.1 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.019 179.943 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.422 ' N ' ' HG2' ' A' ' 4' ' ' GLU . 2.6 t-20 60.33 19.81 9.35 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.005 179.895 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -90.09 -70.86 0.65 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.85 179.968 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -6.18 29.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.366 -179.892 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 72.1 t -66.36 -24.93 34.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.263 -179.876 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.563 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 70.9 ttt180 -147.49 -5.66 0.48 Allowed 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.702 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 ttp180 -58.54 103.36 0.15 Allowed 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 177.643 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.9 t70 59.92 37.51 21.52 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -177.268 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.563 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 4.6 p -31.57 -51.38 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.635 -178.684 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.1 t 62.06 -84.11 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.207 178.749 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.568 HG22 ' H ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -114.87 -161.17 0.76 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.656 179.812 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.568 ' H ' HG22 ' A' ' 14' ' ' THR . . . -95.21 -67.36 0.86 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.462 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.425 HD11 ' N ' ' A' ' 17' ' ' SER . 1.9 pp -85.68 -12.81 50.31 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.007 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.425 ' N ' HD11 ' A' ' 16' ' ' LEU . 38.4 m -52.43 -34.16 47.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -179.06 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -140.81 -73.21 0.34 Allowed 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -179.167 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.524 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 14.3 ptm -48.46 -41.33 29.25 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.936 -178.621 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' A' ' 22' ' ' GLU . . . 50.7 -142.96 14.6 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.002 -179.652 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.1 t70 58.72 -80.2 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.648 0.261 . . . . 0.0 111.228 179.719 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 20' ' ' GLY . 0.8 OUTLIER -65.18 -17.44 64.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.988 0.423 . . . . 0.0 110.228 179.165 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.33 11.21 33.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.795 179.437 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.525 ' HZ ' ' HB3' ' A' ' 54' ' ' ALA . 1.4 t80 -63.53 -45.28 91.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.444 179.95 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.439 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 24.2 mt-10 -63.37 -55.63 33.97 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.018 -179.653 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 9.4 Cg_endo -54.93 -16.1 11.2 Favored 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 121.74 1.626 . . . . 0.0 110.704 179.344 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.452 ' HB3' ' O ' ' A' ' 24' ' ' PHE . 1.0 OUTLIER -85.62 -34.31 21.43 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.461 -1.245 . . . . 0.0 108.881 178.842 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.499 HD13 HD11 ' A' ' 31' ' ' LEU . 0.7 OUTLIER -77.32 -39.26 48.4 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.988 178.869 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -64.52 -37.14 86.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.214 -179.308 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 89.4 p -66.33 -14.56 62.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.945 -179.172 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.499 HD11 HD13 ' A' ' 28' ' ' LEU . 96.5 mt -60.15 -29.15 68.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.747 0.308 . . . . 0.0 111.154 -179.893 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.9 m -92.46 20.88 5.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.667 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.706 HD22 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -75.3 150.56 38.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.851 179.995 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -67.05 -20.7 65.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.304 -179.807 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.418 ' HB2' ' OD1' ' A' ' 33' ' ' ASN . 7.5 m-20 -78.65 162.98 25.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.893 0.378 . . . . 0.0 111.052 -179.821 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -104.57 -44.43 4.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.829 -179.7 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.496 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 71.4 mtp85 -58.83 -58.36 8.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.663 -179.703 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.455 ' HB ' ' OD1' ' A' ' 33' ' ' ASN . 71.1 mt -50.05 -40.6 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.496 -179.582 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.706 ' HB2' HD22 ' A' ' 33' ' ' ASN . 43.1 ttp180 -64.41 -40.22 95.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.012 179.896 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -59.8 -58.86 12.0 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.285 179.952 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.66 -28.81 6.34 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.683 0.278 . . . . 0.0 111.173 179.675 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.24 -56.37 23.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.721 179.702 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.586 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -64.24 -32.47 74.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.611 179.445 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.422 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 12.6 m95 -55.72 -32.02 62.98 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.959 179.926 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.444 ' HA ' HD21 ' A' ' 48' ' ' ASN . 50.9 mm -98.51 -24.52 4.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.61 179.507 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.586 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 5.6 mm -55.43 -44.59 76.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.654 -179.979 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.34 -22.75 59.15 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.796 -0.716 . . . . 0.0 113.214 -179.397 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.444 HD21 ' HA ' ' A' ' 45' ' ' ILE . 44.1 m-80 -68.42 -40.55 81.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.81 0.305 . . . . 0.0 111.445 -179.797 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -97.15 112.22 24.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.718 0.294 . . . . 0.0 110.452 -179.929 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.648 ' H ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -77.22 58.14 1.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.767 179.762 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -102.7 172.69 6.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.935 -179.526 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -66.25 -45.47 80.44 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.876 -179.307 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -6.92 13.26 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.244 -0.183 . . . . 0.0 111.118 179.893 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.525 ' HB3' ' HZ ' ' A' ' 24' ' ' PHE . . . -95.65 8.92 42.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.011 0.434 . . . . 0.0 111.042 -178.752 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 45.4 t -92.01 -59.11 3.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.558 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.401 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 27.3 tt0 -60.29 -49.64 89.63 Favored Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.495 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.455 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 58.4 Cg_exo -38.23 -44.88 2.06 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.709 2.273 . . . . 0.0 113.391 -179.088 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 73' ' ' ALA . 8.0 mt -62.55 -54.05 45.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.321 -179.369 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 83.1 mt -50.53 -53.95 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.048 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -24.27 63.13 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -177.956 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.547 ' HG ' HG13 ' A' ' 69' ' ' VAL . 3.7 tp -90.13 -20.0 23.63 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -178.716 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.649 HD12 HD11 ' A' ' 92' ' ' LEU . 6.3 mt -69.5 -12.59 61.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.937 0.399 . . . . 0.0 110.635 -179.916 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -112.68 1.73 15.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.978 -179.893 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -61.15 -30.35 70.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.165 0.507 . . . . 0.0 110.642 179.759 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.538 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 26.3 m-20 48.63 27.6 1.54 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.135 -0.939 . . . . 0.0 112.279 179.628 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.468 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 38.6 t -86.32 -15.06 41.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.765 0.316 . . . . 0.0 110.677 179.808 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 118.0 -109.94 1.9 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.504 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.496 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -59.15 -25.42 63.87 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.659 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.547 HG13 ' HG ' ' A' ' 61' ' ' LEU . 41.4 t -71.18 -32.29 47.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.645 178.61 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.538 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 52.8 ttp180 -78.7 -44.39 23.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.698 179.422 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.451 ' HA ' ' HZ ' ' A' ' 99' ' ' PHE . 28.9 t -67.09 -41.73 85.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.452 -179.83 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -51.18 -45.83 51.6 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.417 -179.79 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.575 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . . . -71.75 -31.79 67.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.649 0.262 . . . . 0.0 111.048 179.68 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.586 ' HA ' HD22 ' A' ' 62' ' ' LEU . . . -60.17 -54.22 48.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.755 -179.224 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -61.88 -27.5 68.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.328 -179.645 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.415 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 50.4 m -58.87 -33.98 71.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.127 -179.831 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.569 HD11 HD11 ' A' ' 62' ' ' LEU . 9.1 mp -61.25 -60.64 3.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.89 0.376 . . . . 0.0 110.441 179.455 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -55.84 -24.95 39.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.295 178.909 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.415 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 37.8 mt-30 -70.73 -50.91 31.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.741 179.767 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.541 ' HB ' HG22 ' A' ' 85' ' ' VAL . 74.3 mt -66.03 -60.79 2.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.057 -179.984 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.64 127.46 0.02 OUTLIER Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.621 179.913 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 145.06 178.04 20.33 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.848 179.775 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.53 -34.35 78.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.846 0.355 . . . . 0.0 110.714 -179.99 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.476 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -57.72 -47.82 81.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.942 -179.881 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.541 HG22 ' HB ' ' A' ' 80' ' ' ILE . 33.1 t -70.56 -26.33 28.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.419 . . . . 0.0 110.648 179.654 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -58.61 -23.13 58.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.671 -179.895 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.9 -27.97 26.26 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.193 0.52 . . . . 0.0 109.771 179.434 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.98 -40.03 83.2 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.213 179.049 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.518 ' HE1' HD22 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.2 -36.96 74.95 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.656 179.181 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.46 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 35.9 mt-10 -57.86 -32.72 67.94 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.623 178.876 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.8 tmtm? -64.56 -52.65 56.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.736 179.57 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.649 HD11 HD12 ' A' ' 62' ' ' LEU . 54.4 mt -61.83 -37.59 85.01 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.717 0.294 . . . . 0.0 110.712 -179.915 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.405 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -54.58 -31.03 56.06 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.179 0.514 . . . . 0.0 110.282 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -86.66 -21.93 26.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.013 179.425 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.2 p -118.01 38.15 3.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.122 -179.869 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.406 ' HA2' ' HB2' ' A' ' 101' ' ' ARG . . . -39.4 109.36 0.11 Allowed Glycine 0 C--N 1.334 0.448 0 CA-C-N 116.092 -0.504 . . . . 0.0 113.198 -179.78 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.1 t -151.88 138.55 18.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.834 0.349 . . . . 0.0 111.459 -179.888 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 55.09 -139.24 41.35 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.81 179.673 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.451 ' HZ ' ' HA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -94.76 -13.97 25.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.843 0.354 . . . . 0.0 110.6 -179.903 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.416 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -56.37 -35.02 67.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.829 179.824 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.406 ' HB2' ' HA2' ' A' ' 96' ' ' GLY . 11.0 tpt180 -61.74 -60.27 3.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.335 179.486 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.502 ' HG3' ' ND2' ' A' ' 106' ' ' ASN . 32.2 ttpt -51.55 -32.62 28.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.022 179.277 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.514 HG12 ' HB3' ' A' ' 74' ' ' ALA . 22.7 t -64.57 -46.87 91.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.97 179.484 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.516 ' HB3' HD13 ' A' ' 92' ' ' LEU . . . -61.49 -51.92 66.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.977 -179.562 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 59.9 t -63.62 -60.9 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.273 -179.022 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.502 ' ND2' ' HG3' ' A' ' 102' ' ' LYS . 17.3 m-80 -57.26 -30.08 64.36 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.744 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.03 -29.44 67.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.165 0.507 . . . . 0.0 110.039 -179.892 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.518 HD22 ' HE1' ' A' ' 89' ' ' MET . 98.0 mt -55.61 -25.29 37.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.011 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -51.26 -34.97 35.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.9 p -95.99 -57.0 2.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.329 179.994 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.959 179.993 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.4 ttp . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.866 0.365 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.54 112.76 14.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.979 179.926 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 57.87 85.26 0.09 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.83 -179.994 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -152.29 -63.6 0.17 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.612 -179.871 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -127.3 112.21 14.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.679 179.731 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -83.27 21.58 1.11 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.328 -179.814 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 17.9 p-90 -137.67 20.6 2.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 65.9 t -133.61 -32.44 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.816 179.742 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.523 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 8.6 ptm180 -96.47 -0.84 48.48 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.925 179.704 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.515 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 47.8 ttp180 -65.37 105.43 1.15 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.638 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.61 ' HB2' ' HG2' ' A' ' 18' ' ' ARG . 16.1 m-20 74.18 1.84 3.99 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.048 -179.404 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.523 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 2.6 p -59.67 142.6 14.91 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.191 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.599 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.49 ' HB2' ' O ' ' A' ' 12' ' ' VAL . 36.5 t 175.29 -40.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.834 -179.607 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.569 HG23 ' H ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -106.39 -162.31 0.85 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.184 179.433 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.569 ' H ' HG23 ' A' ' 14' ' ' THR . . . -93.28 -68.99 0.77 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.459 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -87.59 -15.77 36.43 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.51 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.3 t -53.09 -51.89 60.38 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.731 -179.108 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.61 ' HG2' ' HB2' ' A' ' 11' ' ' ASP . 17.9 tpp85 -172.87 118.92 0.34 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.848 0.356 . . . . 0.0 111.308 -179.86 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 95.2 mmm -133.33 -27.41 1.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.54 179.422 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 102.1 -54.12 0.77 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.767 179.661 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -141.24 -21.65 0.76 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.626 0.251 . . . . 0.0 111.499 -179.61 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -77.5 -28.23 52.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.438 -179.635 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.406 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . -104.84 -7.81 19.15 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.54 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.432 ' HZ ' ' HB1' ' A' ' 54' ' ' ALA . 1.3 t80 -60.93 -48.01 83.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.24 -179.917 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -55.26 36.61 Favored Pre-proline 0 C--N 1.33 -0.249 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.238 179.775 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.406 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 52.5 Cg_exo -49.73 -26.34 13.12 Favored 'Trans proline' 0 C--N 1.357 1.019 0 C-N-CA 121.726 1.617 . . . . 0.0 110.458 179.022 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.542 HD12 HD12 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -76.93 -42.51 39.08 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.554 179.186 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.542 HD13 HD13 ' A' ' 31' ' ' LEU . 11.7 tp -76.16 -17.15 59.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.04 178.937 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -74.53 -32.16 62.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.744 -179.79 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.475 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 71.6 m -66.41 -22.48 66.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.235 -179.779 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.665 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 93.6 mt -67.01 -9.54 40.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.81 0.338 . . . . 0.0 110.851 179.942 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.4 t -112.42 19.57 17.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.8 179.853 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.475 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 77.0 m-20 -89.82 147.53 23.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.212 -179.974 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -66.23 -23.05 66.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.772 179.835 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -78.01 149.18 34.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.935 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.6 p90 -93.28 -38.45 11.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.861 180.0 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.427 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 72.9 mtt-85 -60.4 -54.08 49.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.314 179.693 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.3 mm -54.57 -40.88 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.589 -179.359 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.665 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 39.7 ttm180 -65.46 -27.34 68.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.381 -179.774 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.474 ' HA2' HG11 ' A' ' 69' ' ' VAL . . . -64.4 -63.0 4.61 Favored Glycine 0 N--CA 1.453 -0.183 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.546 -179.782 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.57 -22.69 0.3 Allowed 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 179.995 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.422 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.5 -57.31 13.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.727 0.298 . . . . 0.0 110.924 179.85 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.97 -24.89 66.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.922 0.392 . . . . 0.0 110.805 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -61.85 -39.2 91.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.394 -179.925 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 33.5 mm -100.93 -21.62 5.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-O 120.831 0.348 . . . . 0.0 111.8 -179.521 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.542 HD12 HD12 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -54.52 -38.01 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.265 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.3 -20.6 79.6 Favored Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 120.507 -0.854 . . . . 0.0 113.205 -178.979 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.8 -0.8 9.77 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.383 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.426 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 91.0 m-85 -103.68 -34.01 8.76 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.716 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.426 ' HB2' ' O ' ' A' ' 49' ' ' PHE . 16.8 mt-30 67.31 57.27 0.59 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.245 0.545 . . . . 0.0 110.976 179.9 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -128.26 164.72 21.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.041 -179.803 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -65.48 -32.48 74.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.149 0.5 . . . . 0.0 110.098 179.355 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -69.3 -9.65 54.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.806 179.81 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.499 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -104.68 2.16 30.18 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.997 -179.378 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.2 t -86.57 -47.72 16.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.444 -179.416 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.475 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 23.2 tt0 -60.35 -47.76 95.67 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.788 -179.838 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.475 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 98.7 Cg_exo -43.68 -42.7 11.56 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.589 2.193 . . . . 0.0 113.002 -179.622 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.54 HD13 HD13 ' A' ' 77' ' ' LEU . 11.3 mt -64.66 -39.79 94.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.057 -179.874 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.6 mm -54.57 -57.66 5.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.981 -179.564 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.2 tmmm? -70.07 -28.46 65.45 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -178.353 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 4.7 tp -89.62 -21.39 22.83 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -177.521 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.585 HD11 HD23 ' A' ' 92' ' ' LEU . 22.4 mt -67.19 -20.81 65.77 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.584 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -92.41 -11.38 35.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.676 178.764 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.402 ' OD2' ' HB ' ' A' ' 69' ' ' VAL . 11.9 t70 -52.27 145.76 10.38 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.883 -178.523 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -118.29 27.0 9.23 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.021 -179.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.505 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 27.0 t -86.44 -36.38 19.13 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.898 -179.903 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 126.76 -96.72 0.47 Allowed Glycine 0 N--CA 1.452 -0.263 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.921 -179.603 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.427 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -61.48 -26.97 68.25 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.104 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.505 ' HB ' ' HB3' ' A' ' 66' ' ' SER . 32.2 t -67.95 -36.48 75.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.106 178.999 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -74.04 -55.3 6.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.358 179.549 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 36.8 t -59.07 -25.76 64.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.929 179.833 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.59 -45.6 89.87 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.367 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.525 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . . . -70.04 -30.28 67.52 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.863 0.363 . . . . 0.0 110.674 179.664 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.75 -53.04 61.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.897 -179.439 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -66.22 -22.53 66.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.682 -179.152 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.542 ' HA ' HE21 ' A' ' 79' ' ' GLN . 40.4 t -58.59 -32.84 69.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.488 -179.645 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.569 HD21 ' HE2' ' A' ' 89' ' ' MET . 7.2 mp -55.38 -62.27 1.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.503 -179.82 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.455 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 42.2 mt-10 -55.42 -32.84 63.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.255 179.563 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.542 HE21 ' HA ' ' A' ' 76' ' ' SER . 22.7 mt-30 -70.7 -27.17 63.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.165 -179.961 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 76' ' ' SER . 96.7 mt -83.16 -59.02 3.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.769 -179.284 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.629 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . -179.56 -116.37 0.51 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.034 -1.079 . . . . 0.0 113.411 -179.516 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.436 ' O ' ' HB2' ' A' ' 86' ' ' ARG . . . -157.91 -71.02 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 121.208 -0.52 . . . . 0.0 112.022 -179.972 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.4 ' HG3' ' NH2' ' A' ' 86' ' ' ARG . 43.1 tt0 -72.24 -21.83 61.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.864 0.364 . . . . 0.0 111.244 -179.922 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.629 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.0 OUTLIER -75.58 -56.97 4.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.206 -178.912 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' ' SD ' ' A' ' 89' ' ' MET . 0.4 OUTLIER -68.3 -29.94 46.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.413 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 33.1 ttp180 -41.83 -35.05 0.74 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.921 -179.401 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.83 -49.37 75.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.872 0.368 . . . . 0.0 110.764 -179.877 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.44 -34.54 74.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.859 179.588 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.612 ' HG3' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -60.64 -48.45 81.71 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.18 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 46.7 mt-10 -56.13 -35.6 67.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.425 178.051 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -76.54 -25.86 54.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.979 179.753 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.585 HD23 HD11 ' A' ' 62' ' ' LEU . 0.9 OUTLIER -84.46 -24.98 29.26 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.774 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.71 -28.05 68.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.894 178.904 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -80.24 -25.66 39.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.258 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.8 p -109.42 17.18 21.72 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.433 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.543 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -54.49 116.82 6.89 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 114.7 -1.136 . . . . 0.0 113.311 -179.079 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.3 t -142.41 132.14 24.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.861 0.362 . . . . 0.0 110.958 179.258 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.26 -124.72 35.51 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.559 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.442 ' O ' HG23 ' A' ' 103' ' ' VAL . 68.5 t80 -79.91 -29.99 39.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.881 0.372 . . . . 0.0 110.37 179.583 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.407 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.79 -36.11 35.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.483 179.837 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.543 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 23.4 ttt180 -70.4 -61.11 1.9 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.655 -179.535 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -47.8 -22.27 0.52 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.238 -179.492 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 99' ' ' PHE . 39.2 t -63.53 -60.27 3.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.792 -179.916 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.612 ' HA ' ' HG3' ' A' ' 89' ' ' MET . . . -57.99 -62.35 1.88 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.224 0.535 . . . . 0.0 112.431 -179.203 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.404 HG11 ' H ' ' A' ' 106' ' ' ASN . 3.1 p -52.68 -56.81 5.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.227 -0.897 . . . . 0.0 113.267 -178.294 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.404 ' H ' HG11 ' A' ' 105' ' ' VAL . 55.1 t30 -59.97 -35.38 74.87 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -178.813 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.547 ' HD2' ' HG2' ' A' ' 89' ' ' MET . 30.2 t80 -61.8 -25.48 67.52 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.98 0.419 . . . . 0.0 110.688 -179.323 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 99.3 mt -58.95 -13.18 5.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.592 179.694 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -64.98 -7.24 10.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.604 179.84 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 73.0 p -93.12 -49.82 5.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.648 179.64 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.884 179.486 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.792 0.329 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 56.72 -91.42 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.482 179.968 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -166.3 -17.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.66 -179.975 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -57.34 -27.76 62.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.967 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.538 ' C ' ' H ' ' A' ' 7' ' ' TRP . 26.9 t-20 -82.37 -91.98 0.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.964 -179.864 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt 67.39 -15.57 0.17 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.553 -179.89 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.538 ' H ' ' C ' ' A' ' 5' ' ' ASN . 95.1 m95 -113.54 -143.27 0.39 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.452 -179.992 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.47 ' C ' ' H ' ' A' ' 10' ' ' ARG . 0.4 OUTLIER 67.75 144.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 120.855 0.359 . . . . 0.0 111.26 -179.996 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.567 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 33.1 ttp180 72.46 -26.12 0.18 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.573 179.905 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.502 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 57.0 mtp180 -67.46 119.95 13.12 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 177.763 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.502 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 23.8 m-20 70.38 17.36 6.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.069 0.461 . . . . 0.0 110.104 -178.688 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.567 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 9.9 p -55.18 164.71 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.215 -179.766 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.427 ' N ' HG21 ' A' ' 12' ' ' VAL . 30.3 t 69.85 -1.88 2.2 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.627 179.187 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 82.4 p -142.28 11.73 1.95 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.006 0.431 . . . . 0.0 110.747 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.442 ' O ' ' HG3' ' A' ' 19' ' ' MET . . . -94.91 -10.02 32.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.23 -179.768 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.636 ' HA ' ' HB1' ' A' ' 23' ' ' ALA . 73.2 mt -54.44 -16.18 2.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.34 -179.256 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 67.8 m -48.5 -52.29 23.12 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.581 0.229 . . . . 0.0 110.986 -179.826 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 167.82 21.3 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.464 179.607 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 15' ' ' ALA . 12.5 mtt -61.25 -20.82 63.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.438 -179.468 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.87 -123.67 7.85 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.661 -0.781 . . . . 0.0 113.184 179.218 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -57.81 -39.0 76.55 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.752 0.31 . . . . 0.0 111.087 -179.694 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -60.9 -15.7 33.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.614 179.769 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.636 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -105.01 -15.35 15.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.711 -179.51 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.409 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 1.9 t80 -57.99 -52.38 65.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.717 -179.028 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.451 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 2.8 mt-10 -62.63 -57.17 23.63 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.674 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 13.9 Cg_endo -57.41 -12.03 9.82 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 122.112 1.875 . . . . 0.0 111.892 -179.729 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.617 HD23 ' HA ' ' A' ' 46' ' ' ILE . 1.9 tp -84.89 -44.3 13.31 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.96 179.899 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 pp -84.34 -16.34 43.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.693 178.733 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -71.76 -31.38 66.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.086 179.566 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 t -66.35 -19.09 65.71 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.122 179.986 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.583 HD11 ' HB3' ' A' ' 57' ' ' PRO . 91.5 mt -57.14 -16.77 8.49 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.856 0.36 . . . . 0.0 111.03 -179.926 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 74.6 m -94.7 23.46 5.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.224 -179.94 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.502 HD22 ' HB2' ' A' ' 39' ' ' ARG . 2.2 p30 -85.37 147.48 26.49 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.819 0.342 . . . . 0.0 110.583 -179.728 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -66.95 -25.89 66.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.143 -178.885 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -82.72 163.54 21.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.35 . . . . 0.0 111.082 -179.798 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.406 ' HB2' ' HG ' ' A' ' 66' ' ' SER . 67.7 p-90 -101.75 -35.68 8.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.141 179.965 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.497 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 67.9 ttt180 -62.78 -29.74 70.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.35 -179.78 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.1 mt -76.5 -48.98 25.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.785 0.326 . . . . 0.0 111.256 -179.793 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.502 ' HB2' HD22 ' A' ' 33' ' ' ASN . 31.5 ttm180 -55.69 -27.83 52.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.254 -179.715 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.642 ' HA2' HD22 ' A' ' 61' ' ' LEU . . . -67.68 -55.68 13.78 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.744 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.13 -29.67 14.18 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.774 0.321 . . . . 0.0 111.245 179.793 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.456 ' O ' HD12 ' A' ' 27' ' ' LEU . . . -57.73 -54.37 47.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.851 179.797 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.52 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -68.43 -29.3 67.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.008 179.943 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.6 m95 -59.94 -38.04 81.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.626 -179.899 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.1 mm -98.87 -19.49 5.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.837 0.351 . . . . 0.0 111.718 -179.776 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.617 ' HA ' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -52.74 -44.03 46.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.009 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.97 -13.51 83.09 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.69 -0.767 . . . . 0.0 113.701 -178.748 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.528 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.9 OUTLIER -70.77 -3.5 19.11 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 -179.37 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -99.59 -30.4 12.15 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.27 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.429 ' HG3' HG13 ' A' ' 80' ' ' ILE . 1.1 tt0 71.0 51.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.135 0.493 . . . . 0.0 111.029 179.284 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -127.45 155.71 43.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.13 -179.97 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.41 ' H ' ' CD ' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -63.51 -30.3 71.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.664 179.734 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.405 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 38.0 ttt180 -69.22 -10.11 56.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.96 179.738 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.576 ' HB2' HG21 ' A' ' 46' ' ' ILE . . . -94.54 11.96 29.08 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -179.032 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.41 HG21 ' O ' ' A' ' 52' ' ' GLU . 23.0 m -91.68 -42.15 13.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.359 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.578 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 6.5 tp10 -60.34 -50.31 86.42 Favored Pre-proline 0 C--N 1.327 -0.378 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.667 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.583 ' HB3' HD11 ' A' ' 31' ' ' LEU . 52.3 Cg_exo -53.67 -23.54 26.46 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.262 1.975 . . . . 0.0 112.88 -179.271 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.488 HD22 ' HA ' ' A' ' 73' ' ' ALA . 57.2 mt -84.99 -40.69 16.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.09 -179.58 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.563 ' HA ' HD11 ' A' ' 62' ' ' LEU . 49.9 mm -58.88 -43.33 88.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.837 -179.536 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -70.03 -26.65 64.14 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -178.821 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.642 HD22 ' HA2' ' A' ' 40' ' ' GLY . 5.2 tp -88.97 -29.07 19.81 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -178.21 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.62 HD12 HD13 ' A' ' 77' ' ' LEU . 15.5 mt -58.66 -19.16 36.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.975 0.417 . . . . 0.0 110.565 179.153 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -111.93 -0.93 15.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.162 -179.882 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.506 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 6.2 t70 -61.25 -36.95 81.38 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.408 0.623 . . . . 0.0 110.482 -179.849 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 10.8 m-20 56.7 25.67 10.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.522 179.296 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.448 ' HB2' ' OD1' ' A' ' 64' ' ' ASP . 0.3 OUTLIER -80.5 -27.75 37.66 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 121.057 0.456 . . . . 0.0 109.959 179.262 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 131.9 -103.64 0.54 Allowed Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.554 179.709 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.497 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -58.34 -24.31 59.37 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 117.041 0.42 . . . . 0.0 109.949 179.855 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 4.0 m -70.24 -40.19 77.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 121.231 0.539 . . . . 0.0 109.774 178.495 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.457 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 50.5 ttp180 -71.12 -44.96 64.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.542 179.921 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.4 p -67.16 -35.08 78.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.87 179.469 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.475 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -62.22 -55.8 25.74 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.647 -179.736 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.488 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -58.08 -39.5 78.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.899 0.381 . . . . 0.0 110.714 179.749 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.466 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.89 -46.07 90.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.512 -179.76 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.475 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 0.2 OUTLIER -70.85 -32.64 69.73 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.423 -179.041 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.453 ' HB2' HD22 ' A' ' 58' ' ' LEU . 46.5 m -61.79 -34.44 75.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.806 0.336 . . . . 0.0 110.996 -179.791 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.62 HD13 HD12 ' A' ' 62' ' ' LEU . 66.5 mt -59.64 -60.65 3.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.977 0.418 . . . . 0.0 110.62 179.576 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -65.34 -18.18 65.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.641 179.456 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.425 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 8.7 tt0 -56.88 -39.93 75.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.91 -179.897 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.429 HG13 ' HG3' ' A' ' 50' ' ' GLN . 3.2 mp -80.43 -56.77 5.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.928 179.584 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.461 ' HA2' ' HH ' ' A' ' 107' ' ' TYR . . . 71.03 58.56 5.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.339 -179.781 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -135.13 179.84 17.27 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.304 179.786 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.08 -22.1 64.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.809 0.338 . . . . 0.0 110.836 179.957 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.539 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -76.9 -31.42 56.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.786 -179.271 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.539 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 38.2 t -70.31 -33.76 55.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.915 0.388 . . . . 0.0 110.195 179.412 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.8 ttp180 -56.26 -21.93 26.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.062 179.961 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.33 -33.86 37.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.688 179.928 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.18 -31.03 68.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.971 179.805 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.541 ' HE2' ' HA ' ' A' ' 104' ' ' ALA . 10.0 mmm -72.21 -50.03 30.67 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.306 179.866 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.43 -35.62 65.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.168 179.4 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.45 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 11.7 tmtt? -70.27 -31.73 69.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.866 179.853 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.592 HD23 HD13 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -85.99 -28.62 24.09 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 179.845 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.46 -28.91 60.94 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.849 178.83 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -80.18 -27.76 38.86 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.077 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.3 p -109.35 25.96 11.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.68 178.827 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.489 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -49.75 113.06 1.64 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.45 -178.983 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 58.2 m -141.1 130.4 23.63 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.181 -0.304 . . . . 0.0 110.181 179.435 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.26 -130.27 12.23 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.063 -179.381 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -95.82 -15.82 22.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.732 0.301 . . . . 0.0 110.839 179.939 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.451 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -51.71 -42.89 62.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.437 -179.749 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.489 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 60.5 ttt180 -59.29 -60.7 3.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.01 -179.969 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.6 tttp -49.91 -24.33 2.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.25 0.548 . . . . 0.0 110.333 179.621 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.1 t -79.82 -48.56 20.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.388 179.943 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.579 ' HB3' HD22 ' A' ' 92' ' ' LEU . . . -58.62 -53.08 62.35 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.258 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 28.3 t -64.91 -58.99 4.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.917 -178.084 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -55.59 -38.61 69.63 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.519 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.496 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 36.7 t80 -63.34 -25.22 68.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.829 0.347 . . . . 0.0 111.231 -178.805 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 94.0 mt -56.37 -20.13 17.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.543 -179.785 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -78.56 6.23 9.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.603 -179.416 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.0 p -138.9 -53.46 0.58 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.469 179.917 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.8 p-80 . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.43 -179.788 . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptt? . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.802 0.334 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.35 134.83 41.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.94 179.944 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.6 t70 62.95 12.97 6.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.896 -179.888 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -128.07 -15.45 4.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.918 179.753 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -70.61 111.21 5.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.819 179.907 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -171.64 -49.59 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.01 -179.916 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -86.86 32.84 0.66 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.986 -179.943 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 53.1 t -58.86 -46.61 91.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.658 -179.694 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.466 ' HA ' HG21 ' A' ' 12' ' ' VAL . 14.9 ptm180 -128.3 2.26 5.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.604 0.24 . . . . 0.0 111.487 -179.662 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.449 ' HA ' ' NE ' ' A' ' 10' ' ' ARG . 5.2 mmp_? -64.37 105.6 0.96 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.274 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.435 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 16.0 t70 77.97 -34.29 0.18 Allowed 'General case' 0 N--CA 1.465 0.291 0 O-C-N 123.694 0.621 . . . . 0.0 110.924 -179.514 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.466 HG21 ' HA ' ' A' ' 9' ' ' ARG . 1.5 m -85.78 96.68 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-O 120.975 0.417 . . . . 0.0 110.839 179.58 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 49.7 m -82.98 -167.94 1.87 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.477 -179.361 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.519 ' HB ' ' HB3' ' A' ' 17' ' ' SER . 2.6 m 63.32 169.23 0.15 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.839 -179.834 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.497 ' H ' HG23 ' A' ' 14' ' ' THR . . . -95.51 -68.47 0.8 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.838 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mt -86.25 -22.78 26.67 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -178.48 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.519 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 28.3 t -56.18 -48.41 76.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.525 0.202 . . . . 0.0 111.352 -179.28 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.498 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 3.2 tpm_? -164.95 97.56 0.74 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.828 0.347 . . . . 0.0 111.299 -179.907 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.522 ' HB3' ' HB3' ' A' ' 22' ' ' GLU . 4.4 mmt -133.3 -20.81 2.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.834 179.575 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.74 -116.28 4.95 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.39 -179.898 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -83.35 -17.89 40.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.731 0.301 . . . . 0.0 110.987 -179.984 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.522 ' HB3' ' HB3' ' A' ' 19' ' ' MET . 9.6 tp10 -71.3 -30.13 65.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.857 179.817 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.645 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -100.77 3.32 42.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.115 -179.863 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.499 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 1.9 t80 -56.49 -64.82 0.74 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.725 179.798 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.497 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.36 -50.8 72.4 Favored Pre-proline 0 C--N 1.329 -0.314 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 179.563 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.645 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 53.9 Cg_exo -45.81 -25.06 2.36 Favored 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 121.933 1.756 . . . . 0.0 110.826 179.706 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.648 HD22 HG13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -82.62 -47.08 12.49 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.364 178.921 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.26 -39.33 78.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.13 178.443 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -59.81 -29.07 67.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.393 -179.21 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.9 m -64.98 -22.43 67.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.581 -179.356 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.435 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 68.0 mt -69.55 -11.74 61.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.054 -179.844 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.3 t -109.65 13.09 23.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.705 179.889 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -78.55 135.68 37.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.031 -179.862 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -58.22 -26.84 63.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.207 -179.986 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -84.84 130.85 34.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.046 179.993 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -84.04 -27.74 28.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.729 179.809 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.8 mtp180 -62.51 -42.11 99.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.585 179.537 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.4 mt -79.89 -31.57 13.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.768 179.952 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.435 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 35.6 ttm180 -65.53 -36.21 83.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.626 179.732 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -57.34 -48.81 77.67 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.072 179.818 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.31 -35.86 68.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.7 0.285 . . . . 0.0 110.944 179.611 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.407 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.7 -53.2 59.5 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.424 179.514 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.37 90.8 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.454 179.126 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.664 ' HA ' ' NH1' ' A' ' 75' ' ' ARG . 7.9 m95 -63.62 -28.55 70.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.013 -179.233 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.7 mm -98.95 -24.07 4.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.921 0.391 . . . . 0.0 111.108 179.839 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.648 HG13 HD22 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -60.84 -30.97 48.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.847 -179.315 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.5 ' HA3' HH21 ' A' ' 75' ' ' ARG . . . -61.26 -28.99 70.12 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.86 -179.744 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -59.84 -26.2 65.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.85 0.357 . . . . 0.0 110.399 179.857 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.433 ' C ' ' H ' ' A' ' 51' ' ' ASP . 47.0 m-85 -94.94 111.72 23.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.486 179.847 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -80.27 36.72 0.37 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.461 179.831 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.459 ' O ' HG23 ' A' ' 55' ' ' VAL . 20.6 m-20 -102.34 158.18 16.38 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.789 -179.698 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.72 -33.75 75.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.798 -179.189 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 18.8 ttm180 -65.84 -13.44 59.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.951 0.405 . . . . 0.0 110.558 -180.0 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.42 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -105.15 -3.03 23.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.353 179.97 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 51' ' ' ASP . 93.2 t -91.21 -34.26 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.277 -179.907 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.465 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 20.9 tt0 -60.36 -44.85 97.06 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 116.272 -0.422 . . . . 0.0 112.077 -179.864 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.473 ' O ' HD12 ' A' ' 61' ' ' LEU . 94.6 Cg_exo -45.53 -53.0 6.0 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.437 2.091 . . . . 0.0 113.578 -179.548 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.52 HD11 ' HA ' ' A' ' 73' ' ' ALA . 0.1 OUTLIER -54.27 -30.32 50.2 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.965 0.358 . . . . 0.0 111.965 -178.864 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 43.5 mm -55.12 -59.06 2.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.736 0.303 . . . . 0.0 111.584 -179.557 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -70.06 -37.16 75.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.802 -179.518 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.518 ' HG ' HG11 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -52.54 -55.55 21.38 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.91 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.55 HD22 HD22 ' A' ' 92' ' ' LEU . 9.3 mt -51.76 -13.92 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.609 -179.729 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -113.11 -19.15 11.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.024 179.857 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.426 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 7.9 t0 -61.18 -34.56 75.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.005 0.431 . . . . 0.0 111.422 -179.773 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.651 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 14.4 m-20 54.85 29.64 12.36 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.317 -179.707 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.479 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.0 t -83.18 0.29 46.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.383 -179.973 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.61 -78.19 1.67 Allowed Glycine 0 C--O 1.228 -0.237 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.199 -179.665 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.95 -45.2 94.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.158 0.504 . . . . 0.0 109.818 179.32 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.518 HG11 ' HG ' ' A' ' 61' ' ' LEU . 10.7 t -73.63 -46.68 47.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.514 -179.839 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.651 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 14.0 ttp180 -63.35 -59.23 4.97 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -179.357 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.4 t -50.91 -32.78 21.74 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.98 -179.353 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.552 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -54.24 -47.66 67.11 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.817 179.479 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.52 ' HA ' HD11 ' A' ' 58' ' ' LEU . . . -51.04 -32.39 21.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.656 0.265 . . . . 0.0 111.558 179.9 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.94 -60.98 2.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.686 -179.226 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.669 HH21 HE22 ' A' ' 79' ' ' GLN . 0.2 OUTLIER -61.42 -27.92 68.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.711 -179.397 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.403 ' HB2' ' NH2' ' A' ' 75' ' ' ARG . 39.3 t -62.15 -52.67 62.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.726 0.298 . . . . 0.0 111.51 -179.663 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.475 ' HA ' HG11 ' A' ' 85' ' ' VAL . 8.3 mp -55.72 -60.72 3.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.645 -179.83 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -55.57 -24.65 33.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.968 0.413 . . . . 0.0 110.566 179.644 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.669 HE22 HH21 ' A' ' 75' ' ' ARG . 2.0 mt-30 -70.87 -48.25 54.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.132 179.806 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 79.5 mt -71.97 -60.71 2.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.4 -179.494 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.434 ' N ' HG23 ' A' ' 85' ' ' VAL . . . 67.75 121.33 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.729 -179.943 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.496 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 146.11 179.72 22.51 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.762 179.935 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -66.06 -31.72 72.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.919 0.39 . . . . 0.0 110.603 -179.97 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.564 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.59 -52.31 64.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.069 -179.744 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.564 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.1 OUTLIER -70.37 -22.88 24.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.981 0.419 . . . . 0.0 110.518 179.693 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -58.63 -22.15 55.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.382 179.503 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.69 -32.26 57.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.317 179.602 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.23 -48.8 77.91 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.982 179.156 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.536 ' HB3' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -72.12 -24.43 61.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.556 179.115 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.504 ' HG2' ' HE3' ' A' ' 89' ' ' MET . 19.8 mm-40 -66.74 -35.05 79.19 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.999 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -81.49 -28.84 33.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.815 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.55 HD22 HD22 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -85.67 -35.03 21.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.605 0.24 . . . . 0.0 110.864 -179.288 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -55.55 -28.47 55.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.963 0.411 . . . . 0.0 110.496 179.104 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.22 -26.17 39.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.386 179.934 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 50.0 p -117.6 30.96 6.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.615 179.2 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.43 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -53.35 121.55 17.45 Favored Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 115.186 -0.915 . . . . 0.0 113.539 -178.999 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.417 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 29.4 m -154.13 130.27 10.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.833 0.349 . . . . 0.0 110.682 179.124 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.04 -158.45 25.35 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.904 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -55.35 -33.18 63.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.608 0.242 . . . . 0.0 111.247 179.972 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.554 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -48.55 -48.05 38.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.316 -179.913 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.454 ' HA ' HD13 ' A' ' 92' ' ' LEU . 72.0 ttt180 -60.23 -58.35 8.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.994 -179.618 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.518 ' HD2' HD22 ' A' ' 106' ' ' ASN . 4.6 tppp? -45.89 -24.91 0.45 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.381 -179.08 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.554 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 40.3 t -68.37 -52.98 31.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.367 179.763 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.536 ' HA ' ' HB3' ' A' ' 89' ' ' MET . . . -53.41 -63.03 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.499 0.666 . . . . 0.0 112.375 -179.374 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.47 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 32.8 t -52.18 -62.83 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.779 -1.1 . . . . 0.0 113.412 -178.355 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.518 HD22 ' HD2' ' A' ' 102' ' ' LYS . 98.4 m-20 -55.45 -34.22 64.29 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -178.236 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -59.42 -28.53 67.02 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-O 120.987 0.422 . . . . 0.0 111.145 -179.031 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 15.2 mt -62.13 -14.99 42.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.61 179.949 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -79.36 5.81 11.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.863 -179.411 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 35.5 p -146.63 -34.19 0.29 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.734 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 40.8 m80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.293 -179.125 . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.9 mtp . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.667 0.27 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.67 -65.13 0.57 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.309 179.982 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -116.93 -16.82 10.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 0.0 110.696 179.689 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -86.46 118.68 26.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.891 179.959 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 m120 63.71 162.67 0.11 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.22 179.9 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -168.1 -28.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.919 -179.968 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.607 ' HB3' ' HE2' ' A' ' 19' ' ' MET . 93.6 m95 -128.98 82.65 2.1 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.043 0.449 . . . . 0.0 110.789 179.667 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.617 ' HA ' ' HG3' ' A' ' 22' ' ' GLU . 82.0 t -141.88 -71.72 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.718 179.921 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.549 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 14.0 ptm180 -99.93 -15.01 18.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.787 -179.899 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.402 ' N ' ' HD2' ' A' ' 10' ' ' ARG . 9.8 mpt_? -67.19 114.38 5.88 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 178.256 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.4 t70 73.81 12.02 4.47 Favored 'General case' 0 C--O 1.232 0.141 0 O-C-N 123.436 0.46 . . . . 0.0 110.982 -179.596 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.549 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 9.8 p -56.78 169.13 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.887 179.911 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.503 ' H ' HG22 ' A' ' 12' ' ' VAL . 26.7 t 68.15 8.88 6.84 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 120.914 0.388 . . . . 0.0 110.916 179.751 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 29.6 m -146.82 -23.12 0.41 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.407 179.678 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.93 -2.89 22.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.353 179.981 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 pp -66.43 -14.07 61.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.794 0.33 . . . . 0.0 110.975 179.946 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.7 t -79.32 -4.67 51.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.571 179.601 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -148.94 -64.64 0.23 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.546 -179.963 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.607 ' HE2' ' HB3' ' A' ' 7' ' ' TRP . 24.5 ttm -52.92 -43.66 66.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.022 179.948 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 40.85 39.9 2.07 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.311 -0.471 . . . . 0.0 113.492 179.473 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -141.66 -72.29 0.33 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.857 0.361 . . . . 0.0 110.694 179.903 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.617 ' HG3' ' HA ' ' A' ' 8' ' ' VAL . 11.6 mm-40 -67.86 -16.36 64.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.06 179.562 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.88 9.97 32.61 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.757 179.188 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.466 ' HZ ' ' HB1' ' A' ' 54' ' ' ALA . 15.0 t80 -63.3 -37.15 86.15 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.151 0.501 . . . . 0.0 110.425 179.86 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.408 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 1.1 mp0 -63.28 -57.68 19.36 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.998 179.759 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.408 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.5 Cg_endo -56.08 -14.5 11.7 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 121.484 1.456 . . . . 0.0 110.13 179.235 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.444 ' HB3' ' O ' ' A' ' 24' ' ' PHE . 0.7 OUTLIER -86.86 -37.45 17.7 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.285 -1.325 . . . . 0.0 109.089 178.451 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.495 HD23 HD21 ' A' ' 31' ' ' LEU . 3.4 tm? -75.96 -31.41 59.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.824 179.459 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -71.31 -15.47 62.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.416 179.917 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 65.2 m -66.45 -51.5 56.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.14 -179.125 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.495 HD21 HD23 ' A' ' 28' ' ' LEU . 2.4 pp -60.45 -7.71 2.26 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.7 0.286 . . . . 0.0 111.527 -179.329 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.9 m -88.93 19.71 3.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.85 0.357 . . . . 0.0 110.449 179.529 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -105.08 150.57 24.89 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.094 179.951 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -67.38 -12.37 60.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.678 179.526 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -76.0 153.57 36.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.651 -179.929 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.3 m95 -102.78 -32.81 9.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.082 -179.7 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.494 ' HG3' HG13 ' A' ' 38' ' ' ILE . 34.0 ptt180 -62.0 -39.49 92.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.938 179.981 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.494 HG13 ' HG3' ' A' ' 37' ' ' ARG . 40.9 mt -82.22 -32.32 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.999 0.428 . . . . 0.0 110.517 179.475 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.56 ' HD2' HG11 ' A' ' 69' ' ' VAL . 0.0 OUTLIER -58.37 -38.83 78.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.302 -179.988 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.53 -53.97 7.07 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.879 -179.462 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.41 -39.14 46.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.709 0.29 . . . . 0.0 111.76 -179.912 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.4 -33.45 75.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.24 -179.759 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.435 ' HB1' HD22 ' A' ' 61' ' ' LEU . . . -85.44 -28.88 24.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.383 -179.88 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.0 m95 -69.53 -31.54 69.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.267 -178.778 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.563 ' HA ' HD21 ' A' ' 48' ' ' ASN . 22.8 mt -99.29 -19.43 5.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.981 0.42 . . . . 0.0 111.199 -179.246 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.57 HG12 ' HA ' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -51.17 -27.53 6.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.826 -179.346 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -93.11 -22.67 26.9 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.111 -179.084 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.563 HD21 ' HA ' ' A' ' 45' ' ' ILE . 37.7 m-80 -69.84 -12.07 61.34 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 -179.589 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -101.94 -35.66 8.91 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.747 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 69.61 72.06 0.24 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 0.0 110.843 179.622 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -126.68 170.53 12.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.277 179.876 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.446 ' O ' HG21 ' A' ' 55' ' ' VAL . 0.5 OUTLIER -66.43 -38.84 88.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.623 -179.292 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.45 ' HB2' ' HE1' ' A' ' 24' ' ' PHE . 0.2 OUTLIER -69.2 -9.98 55.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -179.614 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.57 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -88.59 10.61 19.88 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.902 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.446 HG21 ' O ' ' A' ' 52' ' ' GLU . 27.4 m -92.47 -49.21 13.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.851 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.504 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -60.42 -51.95 76.41 Favored Pre-proline 0 CA--C 1.533 0.297 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.963 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.504 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 71.8 Cg_exo -41.56 -53.06 3.43 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 122.404 2.069 . . . . 0.0 112.536 -179.898 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.584 HD21 ' HG ' ' A' ' 76' ' ' SER . 8.4 mt -52.1 -47.87 65.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.693 -179.399 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 51.2 mt -54.76 -56.91 8.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.208 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.633 ' HZ2' ' HB2' ' A' ' 60' ' ' LYS . 0.1 OUTLIER -69.68 -16.2 63.31 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -178.876 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.666 ' HG ' HG13 ' A' ' 69' ' ' VAL . 0.6 OUTLIER -88.85 -46.26 9.08 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.303 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.508 ' HB2' HD23 ' A' ' 92' ' ' LEU . 7.1 mt -59.61 -15.06 16.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.176 0.512 . . . . 0.0 110.208 -179.306 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -112.31 -11.71 13.67 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.281 179.322 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.495 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 7.1 t70 -61.32 -32.12 71.98 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.772 -179.758 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.618 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 1.3 m-20 57.09 27.18 12.99 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.583 -179.82 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.493 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.5 t -85.55 -3.35 58.84 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.161 -179.941 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.83 -73.34 2.57 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.503 179.914 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -70.32 -43.53 70.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.022 0.439 . . . . 0.0 110.029 179.536 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.666 HG13 ' HG ' ' A' ' 61' ' ' LEU . 4.7 t -73.83 -33.49 37.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.386 179.949 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.618 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 62.5 ttt180 -77.49 -53.58 7.45 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.128 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.465 ' O ' ' HG3' ' A' ' 75' ' ' ARG . 90.8 p -50.8 -55.45 16.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.572 -178.949 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -45.35 -32.3 3.71 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 121.202 -0.523 . . . . 0.0 113.071 -179.553 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.447 ' HB3' ' HA ' ' A' ' 58' ' ' LEU . . . -69.47 -48.83 59.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.646 0.26 . . . . 0.0 111.179 179.94 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.65 -35.77 66.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.283 -179.616 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.465 ' HG3' ' O ' ' A' ' 71' ' ' SER . 8.8 mtp85 -74.27 -34.04 63.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.319 179.874 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.711 ' HA ' HE21 ' A' ' 79' ' ' GLN . 31.0 t -61.44 -37.02 82.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.709 -179.318 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.443 HD12 HD11 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -59.95 -60.2 4.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.648 0.261 . . . . 0.0 111.072 179.944 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.44 -29.36 67.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.262 179.486 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.711 HE21 ' HA ' ' A' ' 76' ' ' SER . 21.4 mt-30 -70.67 -36.86 73.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.758 0.313 . . . . 0.0 110.761 179.647 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 94.2 mt -80.3 -61.51 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.528 -179.692 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.44 122.47 0.01 OUTLIER Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.664 -179.846 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.425 ' O ' ' HG3' ' A' ' 86' ' ' ARG . . . 145.91 171.02 15.05 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.624 -179.992 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.4 ' HA ' ' HD2' ' A' ' 86' ' ' ARG . 36.0 tt0 -62.63 -26.97 68.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.643 0.258 . . . . 0.0 111.384 -179.752 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.525 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -62.22 -49.26 76.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.028 0.442 . . . . 0.0 110.288 179.785 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.525 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.1 OUTLIER -70.85 -23.73 24.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.16 179.947 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 82' ' ' GLY . 98.5 mtt180 -58.64 -27.76 65.03 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.871 0.367 . . . . 0.0 110.558 179.533 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.34 -29.09 63.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.145 179.585 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.36 -45.39 63.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.843 179.738 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.491 ' HB2' ' HB3' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.29 -33.08 71.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.886 0.374 . . . . 0.0 110.26 179.562 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.96 -34.67 76.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.921 178.915 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -61.0 -40.77 94.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.978 179.223 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.508 HD23 ' HB2' ' A' ' 62' ' ' LEU . 66.1 mt -71.21 -38.54 72.03 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.988 179.836 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.437 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -52.76 -27.7 19.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.441 179.84 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -97.49 -10.49 25.25 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 -179.404 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.466 ' OG1' ' HA ' ' A' ' 92' ' ' LEU . 47.4 p -106.16 -31.42 8.69 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.72 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.565 ' HA2' ' HD3' ' A' ' 101' ' ' ARG . . . 52.67 92.9 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.877 -179.866 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.419 ' H ' ' HB2' ' A' ' 101' ' ' ARG . 79.7 m -140.24 129.23 23.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.39 . . . . 0.0 111.575 179.934 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.432 ' HA3' HH22 ' A' ' 70' ' ' ARG . . . 38.72 -127.88 1.88 Allowed Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.548 -0.751 . . . . 0.0 113.767 179.498 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -92.81 -21.88 19.64 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.479 0.18 . . . . 0.0 110.982 -179.703 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.604 ' H ' HH21 ' A' ' 70' ' ' ARG . . . -49.93 -40.03 42.21 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.009 0.433 . . . . 0.0 110.654 179.815 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.565 ' HD3' ' HA2' ' A' ' 96' ' ' GLY . 30.7 tpt85 -57.27 -61.56 2.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.639 179.508 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -55.66 -39.55 71.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.155 179.392 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.3 t -60.88 -36.69 73.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.112 179.901 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.491 ' HB3' ' HB2' ' A' ' 89' ' ' MET . . . -63.42 -60.95 2.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.858 -179.169 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.554 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 58.6 t -60.89 -40.49 85.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.844 -179.205 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -71.1 -28.66 64.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.823 179.743 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -63.51 -50.31 70.11 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -177.8 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 3.2 pp -52.33 -13.32 0.33 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.496 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -78.05 5.91 8.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.962 0.41 . . . . 0.0 110.715 179.335 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.5 m -124.47 -59.6 1.45 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.08 179.94 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 53.1 p-80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.442 179.807 . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 pmm? . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.836 0.35 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.91 -178.97 6.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.028 -179.961 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -92.09 -33.24 14.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.093 179.986 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -92.49 -20.33 21.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.812 179.767 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -119.86 131.08 55.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.137 179.992 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -127.99 1.11 5.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.473 -179.963 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -141.86 -144.8 0.16 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.457 179.885 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 35.7 t 70.19 -83.14 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.722 179.57 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.508 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 13.9 ptm180 -121.54 27.37 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.743 0.306 . . . . 0.0 111.483 -179.466 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.444 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 78.1 ttt180 -59.09 104.41 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.932 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.444 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 13.6 m-20 67.92 -0.85 1.89 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 -179.468 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.508 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 97.9 t -91.82 -37.92 9.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.971 -179.932 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.483 ' HA ' ' HE ' ' A' ' 9' ' ' ARG . 40.0 t 56.65 -88.48 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.608 179.873 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.7 p -81.79 91.99 6.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.935 0.398 . . . . 0.0 111.154 -179.917 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.445 ' HB1' ' HB2' ' A' ' 23' ' ' ALA . . . -95.26 -1.98 50.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.518 -179.642 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.409 ' H ' ' CD1' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -79.28 -13.72 59.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.772 -179.707 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 75.1 m -54.2 -50.78 66.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.321 -179.862 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -174.96 31.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.046 0.451 . . . . 0.0 110.867 -179.689 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 17.2 mmm -103.85 -42.3 5.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.91 -179.709 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.93 172.52 6.6 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.347 -179.803 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 65.56 -73.99 0.06 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.741 0.305 . . . . 0.0 111.373 -179.987 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.6 -43.37 65.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.009 -179.775 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.474 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.56 20.49 18.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.777 -179.535 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.529 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -63.2 -49.68 73.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.026 0.441 . . . . 0.0 110.649 179.933 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -63.32 -53.43 53.17 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.116 179.838 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.474 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 83.7 Cg_exo -41.73 -24.57 0.27 Allowed 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 122.327 2.018 . . . . 0.0 111.961 179.554 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.529 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 70.2 mt -75.91 -57.02 4.12 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.473 178.997 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.53 HD13 HD11 ' A' ' 31' ' ' LEU . 28.5 tp -62.86 -24.56 67.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.101 179.938 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.2 -45.93 37.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 -179.598 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.2 p -63.29 -15.02 55.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.348 -179.8 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.53 HD11 HD13 ' A' ' 28' ' ' LEU . 57.0 mt -63.7 -10.96 22.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.84 0.352 . . . . 0.0 111.03 179.982 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.7 t -95.82 23.33 6.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.679 179.864 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.533 HD22 ' HB2' ' A' ' 39' ' ' ARG . 1.3 p30 -88.7 148.06 24.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.95 -179.614 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -65.6 -29.25 69.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.534 -179.386 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -77.88 163.63 25.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 0.0 111.066 -179.782 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -105.04 -24.94 12.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.594 -179.879 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 56.0 mtm180 -60.9 -39.13 88.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.193 179.736 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.7 mt -79.0 -45.57 24.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.453 -179.508 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.533 ' HB2' HD22 ' A' ' 33' ' ' ASN . 32.0 ttm180 -59.51 -41.3 89.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.23 -179.52 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.619 ' HA2' HD21 ' A' ' 61' ' ' LEU . . . -65.09 -62.84 4.59 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.001 -179.534 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.92 -24.74 2.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.745 0.307 . . . . 0.0 111.187 179.984 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.414 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -63.07 -55.01 29.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.758 179.465 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.02 -22.51 64.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.957 0.408 . . . . 0.0 110.716 179.71 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.3 m95 -56.91 -47.11 81.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.588 -179.967 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.457 ' N ' HD12 ' A' ' 45' ' ' ILE . 4.4 mp -99.5 -20.69 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.0 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.602 HG22 ' HB1' ' A' ' 54' ' ' ALA . 4.1 tt -55.43 -39.21 52.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -178.269 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.502 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -75.45 -11.44 84.29 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.512 -179.079 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -70.69 -10.98 60.63 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.149 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -95.59 -4.19 45.01 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.403 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.508 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.9 OUTLIER 46.41 56.27 6.54 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 179.494 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -127.3 151.29 48.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.893 0.377 . . . . 0.0 110.886 179.723 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -59.8 -22.9 62.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.833 179.717 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.44 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -65.82 -30.64 71.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.643 179.685 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.602 ' HB1' HG22 ' A' ' 46' ' ' ILE . . . -102.18 30.54 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.471 -178.967 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.441 ' CG1' ' N ' ' A' ' 56' ' ' GLU . 9.9 p -91.39 -54.33 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.62 -179.964 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.479 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 10.5 tt0 -61.0 -49.7 87.89 Favored Pre-proline 0 CA--C 1.536 0.406 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.797 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 81.5 Cg_exo -43.53 -36.73 7.26 Favored 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.5 2.133 . . . . 0.0 113.023 -179.313 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.525 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . 27.5 mt -71.24 -47.14 59.0 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.07 -179.658 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.416 ' HA ' HD22 ' A' ' 62' ' ' LEU . 25.3 mt -59.4 -49.38 83.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.969 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.08 -26.81 64.17 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -177.759 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.619 HD21 ' HA2' ' A' ' 40' ' ' GLY . 21.8 tp -90.08 -30.62 17.58 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -178.236 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.525 HD22 HD23 ' A' ' 92' ' ' LEU . 4.0 pp -68.49 -8.9 45.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.121 0.486 . . . . 0.0 110.703 -179.124 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -112.32 0.27 15.64 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.018 179.298 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -61.92 -31.76 72.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.793 -179.668 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.442 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 14.6 t70 59.77 24.8 13.76 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.684 179.576 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.38 -20.61 43.65 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.028 0.442 . . . . 0.0 110.076 179.392 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 128.45 -110.03 1.08 Allowed Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.726 179.49 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -56.86 -23.97 48.19 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.846 0.355 . . . . 0.0 110.084 -179.949 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.542 ' HB ' HD11 ' A' ' 61' ' ' LEU . 3.7 m -69.15 -37.33 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-O 121.35 0.595 . . . . 0.0 110.013 179.298 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' A' ' 62' ' ' LEU . 3.8 ttm180 -63.0 -53.52 52.71 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.529 179.776 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 72.1 m -67.17 -38.7 85.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.424 179.935 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -52.53 -61.76 6.42 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.617 -179.668 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.525 ' HB3' ' HA ' ' A' ' 58' ' ' LEU . . . -59.06 -34.76 72.33 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.684 0.278 . . . . 0.0 111.073 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.2 -58.04 9.96 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.964 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 10.2 ptp180 -55.09 -34.39 63.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.507 -179.02 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.584 ' HA ' HE21 ' A' ' 79' ' ' GLN . 49.9 m -57.16 -34.03 68.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.641 0.258 . . . . 0.0 111.192 179.963 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.4 mp -60.47 -61.08 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.753 0.311 . . . . 0.0 110.977 179.592 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.413 ' HG2' ' HB2' ' A' ' 107' ' ' TYR . 42.9 mt-10 -64.47 -19.23 65.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.274 0.559 . . . . 0.0 110.102 179.073 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.584 HE21 ' HA ' ' A' ' 76' ' ' SER . 8.7 tt0 -70.78 -29.45 65.66 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.705 179.929 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.524 ' HB ' HG22 ' A' ' 85' ' ' VAL . 85.3 mt -84.52 -60.18 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.103 179.961 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.5 123.43 0.04 OUTLIER Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.623 179.908 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 137.45 172.88 12.69 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.576 179.802 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.25 -22.07 27.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.006 0.431 . . . . 0.0 111.074 179.826 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.5 ' HD3' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.94 -63.09 1.37 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.302 -179.872 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.524 HG22 ' HB ' ' A' ' 80' ' ' ILE . 20.3 t -70.67 -21.11 22.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.991 179.687 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.455 ' HA ' ' SD ' ' A' ' 89' ' ' MET . 68.3 mtt180 -53.31 -24.16 11.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.769 -179.529 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.87 -36.47 28.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.409 179.197 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.52 -39.33 70.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.872 -179.987 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.492 ' SD ' ' HB3' ' A' ' 108' ' ' LEU . 19.1 ptt? -63.75 -38.8 92.45 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -179.745 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -68.05 -26.49 65.88 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.446 178.656 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? -72.36 -41.94 65.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.483 179.403 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.525 HD23 HD22 ' A' ' 62' ' ' LEU . 8.8 mt -65.37 -38.42 89.98 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.604 179.917 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.75 -29.65 40.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.734 179.556 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -83.19 -24.62 32.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.352 179.049 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.3 p -114.58 31.49 6.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.178 179.367 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.503 ' HA2' ' HB2' ' A' ' 101' ' ' ARG . . . -45.96 99.15 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.698 -0.683 . . . . 0.0 113.291 -179.355 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.7 m -146.78 130.74 17.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.738 0.304 . . . . 0.0 110.28 179.618 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.87 -144.97 33.15 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.436 -0.888 . . . . 0.0 111.685 -179.386 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.45 -16.01 22.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.782 0.325 . . . . 0.0 110.547 179.604 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.407 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -55.79 -29.47 59.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.456 179.701 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.503 ' HB2' ' HA2' ' A' ' 96' ' ' GLY . 16.0 tpt180 -67.36 -57.67 6.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.996 178.844 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -49.38 -34.7 16.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.955 179.004 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.407 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 38.5 t -61.25 -55.45 24.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.15 179.785 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.501 ' HB3' HD12 ' A' ' 92' ' ' LEU . . . -56.18 -61.64 2.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.859 -179.277 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.479 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 45.1 t -50.76 -52.91 15.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.943 -179.304 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -71.13 -19.66 62.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.305 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.432 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 3.0 t80 -64.31 -51.83 61.49 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -177.721 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.492 ' HB3' ' SD ' ' A' ' 89' ' ' MET . 1.9 pp -52.07 -14.99 0.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.076 -178.982 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -72.41 3.33 4.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.727 0.299 . . . . 0.0 110.62 179.56 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.1 p -141.51 -47.95 0.39 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.268 -179.845 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 43.7 p-80 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.518 -179.971 . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.2 ttp . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 120.883 0.373 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.55 -28.95 68.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.502 -179.843 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -127.97 15.76 6.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.917 -179.655 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 63.65 153.51 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.946 -179.704 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -65.09 90.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.779 179.846 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.424 ' HB3' ' HD3' ' A' ' 10' ' ' ARG . 63.8 mttp -147.25 12.38 1.06 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.351 -179.789 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -120.12 24.43 10.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.701 0.286 . . . . 0.0 111.411 179.995 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 p -85.7 -34.87 8.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.583 -179.838 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.654 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 31.5 ttm180 -155.46 -9.86 0.12 Allowed 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.31 -179.837 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 38.0 mtp180 -61.58 109.05 1.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 177.502 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 4.5 m-20 66.85 30.49 7.82 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -177.194 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.654 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 5.0 p -42.27 150.59 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 CA-C-N 114.803 -1.09 . . . . 0.0 111.42 -179.129 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.476 ' H ' ' HG2' ' A' ' 18' ' ' ARG . 9.7 t -168.7 -73.93 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.058 -178.722 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.583 ' HB ' ' HB3' ' A' ' 17' ' ' SER . 3.1 m -66.85 168.12 10.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.61 179.763 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.561 ' HB2' ' HE1' ' A' ' 19' ' ' MET . . . -95.29 -64.24 1.08 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.082 0.468 . . . . 0.0 111.491 -179.875 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.514 HD23 ' HG ' ' A' ' 27' ' ' LEU . 12.4 mt -71.57 -22.63 61.71 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.12 -178.595 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.583 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 23.1 t -87.0 -51.12 6.2 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.298 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.478 ' C ' ' H ' ' A' ' 20' ' ' GLY . 10.2 mpt_? -78.62 -72.59 0.37 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -178.829 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.561 ' HE1' ' HB2' ' A' ' 15' ' ' ALA . 23.1 ptt? -73.46 27.33 0.07 Allowed 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.004 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.478 ' H ' ' C ' ' A' ' 18' ' ' ARG . . . -53.28 -173.16 0.05 OUTLIER Glycine 0 C--N 1.334 0.433 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.476 179.158 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.403 ' HB3' ' O ' ' A' ' 20' ' ' GLY . 21.4 t70 68.41 -72.95 0.09 Allowed 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -178.803 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -65.58 -26.32 67.8 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.827 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.478 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . -105.49 20.27 19.17 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.497 179.212 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.583 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 4.2 t80 -63.45 -39.49 94.61 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.951 -179.962 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -57.27 -55.13 47.49 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.228 -179.312 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 91.8 Cg_exo -37.54 -30.24 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 C-N-CA 122.627 2.218 . . . . 0.0 111.997 179.079 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.583 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 22.7 mt -71.28 -58.71 3.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.828 179.212 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.542 ' HA ' HD11 ' A' ' 31' ' ' LEU . 41.9 tp -62.8 -21.45 65.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.896 179.997 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -79.55 -47.76 14.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.669 -179.905 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.8 m -66.41 -13.3 60.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.76 -179.758 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.542 HD11 ' HA ' ' A' ' 28' ' ' LEU . 46.8 mt -62.59 -10.27 11.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.658 0.266 . . . . 0.0 111.344 -179.733 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 35.9 m -89.96 6.88 40.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.893 179.933 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.72 HD22 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -83.4 141.01 32.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.145 0.498 . . . . 0.0 111.327 -179.827 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.88 -9.57 45.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.855 -179.745 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -78.61 147.53 33.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.815 0.34 . . . . 0.0 111.108 -179.495 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.8 p-90 -98.62 -37.31 9.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.345 -179.792 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.2 tpt180 -59.51 -43.26 93.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.167 -179.877 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.7 mt -78.07 -49.48 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.219 -179.784 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.72 ' HB2' HD22 ' A' ' 33' ' ' ASN . 42.8 ttp180 -54.87 -30.92 59.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.853 179.824 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.09 -58.92 6.25 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.52 -179.926 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.56 -27.73 2.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.774 0.321 . . . . 0.0 111.329 -179.942 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.43 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.32 -51.96 66.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 179.797 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.516 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -73.17 -31.01 63.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.174 179.867 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.6 m95 -55.92 -37.64 69.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.441 -179.632 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.5 mt -99.56 -22.91 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.078 0.466 . . . . 0.0 110.907 -179.626 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.545 HG23 ' HB3' ' A' ' 54' ' ' ALA . 0.0 OUTLIER -51.35 -39.56 21.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.33 -178.853 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -76.86 -25.7 64.09 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.655 -0.783 . . . . 0.0 113.767 -178.868 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -70.82 -2.05 13.6 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -178.769 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.437 ' HB2' ' HE2' ' A' ' 24' ' ' PHE . 22.4 m-30 -112.71 -12.47 13.37 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.437 -0.505 . . . . 0.0 112.2 -179.449 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.505 ' HG2' HG21 ' A' ' 80' ' ' ILE . 0.6 OUTLIER 53.21 68.93 0.76 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.796 0.332 . . . . 0.0 111.212 179.331 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -127.48 164.25 22.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.869 0.366 . . . . 0.0 111.026 179.963 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -63.34 -43.72 96.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.78 179.564 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -6.53 21.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.29 -179.991 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.545 ' HB3' HG23 ' A' ' 46' ' ' ILE . . . -93.89 1.44 56.36 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.037 0.446 . . . . 0.0 111.041 -178.926 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.7 t -91.34 -49.13 13.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.24 -178.728 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 43.6 tt0 -60.23 -48.79 93.27 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.105 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.455 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 93.6 Cg_exo -43.06 -42.93 9.66 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.381 2.054 . . . . 0.0 112.873 -179.878 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.454 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 4.0 mt -66.35 -36.68 83.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.265 -179.284 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 29.2 mm -59.45 -59.03 4.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.192 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -70.05 -20.79 63.22 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.355 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.638 ' HG ' ' HB ' ' A' ' 69' ' ' VAL . 5.3 mp -83.38 -46.06 12.99 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -178.385 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.9 mt -61.37 -10.9 8.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.091 0.472 . . . . 0.0 110.5 -179.338 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.75 -17.05 13.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.285 179.126 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -62.09 -38.84 90.4 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.936 -179.68 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.57 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 5.3 m-20 57.74 27.39 14.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.712 -179.947 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.81 -25.67 59.18 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.003 0.43 . . . . 0.0 110.326 179.557 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 120.7 -82.12 0.34 Allowed Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.408 179.861 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.74 -33.23 75.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.295 0.569 . . . . 0.0 109.613 179.179 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.638 ' HB ' ' HG ' ' A' ' 61' ' ' LEU . 3.2 m -71.91 -42.14 69.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.473 -179.767 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.57 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 25.7 ttp180 -75.48 -47.57 26.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.076 -179.172 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 46.6 t -58.81 -50.29 74.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.482 179.605 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.9 -51.04 56.13 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.918 179.486 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.454 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -56.52 -33.42 66.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.673 0.273 . . . . 0.0 110.977 179.364 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.91 -54.19 45.39 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.54 -179.546 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -69.76 -19.5 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.732 -179.589 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.535 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 59.8 m -58.74 -47.59 84.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.576 -179.863 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.451 ' HA ' HG22 ' A' ' 85' ' ' VAL . 6.3 mp -56.44 -54.9 40.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.846 -179.973 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.447 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 47.0 mt-10 -49.07 -34.0 12.76 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.422 179.463 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.535 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 18.9 mt-30 -69.91 -41.62 74.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.015 -179.997 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.505 HG21 ' HG2' ' A' ' 50' ' ' GLN . 88.4 mt -69.3 -61.02 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.943 179.645 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.49 113.83 0.01 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.119 -0.562 . . . . 0.0 112.989 179.658 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 156.01 175.2 26.73 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.781 179.709 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.26 -23.34 61.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.841 0.353 . . . . 0.0 110.802 179.724 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.638 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.83 -45.48 61.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.046 -179.796 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.638 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 8.8 p -71.05 -26.47 27.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.231 0.538 . . . . 0.0 110.647 179.761 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.486 ' HG3' ' HE1' ' A' ' 89' ' ' MET . 6.1 ttt180 -53.76 -28.76 36.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.798 179.581 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.18 -32.12 73.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.717 179.71 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.18 -57.89 10.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.343 -179.972 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.584 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.15 -24.61 65.0 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.822 -179.886 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.402 ' N ' ' SD ' ' A' ' 89' ' ' MET . 2.1 tm-20 -63.89 -44.19 93.77 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.119 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -72.22 -22.22 61.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.114 179.533 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.494 HD23 ' O ' ' A' ' 100' ' ' ALA . 0.3 OUTLIER -86.57 -28.54 23.25 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 120.81 0.338 . . . . 0.0 110.269 179.978 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.0 -19.15 65.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.948 179.667 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -84.56 -24.9 29.04 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.177 179.619 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 42.5 p -120.38 19.06 12.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.893 179.101 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -49.75 121.27 9.02 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.271 -179.263 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.6 t -142.59 130.66 21.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.842 0.354 . . . . 0.0 110.987 179.556 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.85 -136.53 46.42 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.677 -179.943 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.434 ' O ' HG22 ' A' ' 103' ' ' VAL . 48.1 t80 -66.25 -34.86 78.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.786 0.327 . . . . 0.0 111.012 179.997 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.494 ' O ' HD23 ' A' ' 92' ' ' LEU . . . -51.59 -33.84 34.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.979 -179.59 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.0 ttp180 -72.63 -55.36 6.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.512 -179.408 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -49.25 -21.64 0.86 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.233 0.54 . . . . 0.0 110.484 179.722 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 55.2 t -71.01 -58.77 4.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.609 179.81 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.584 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.88 -47.57 82.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.276 0.56 . . . . 0.0 112.368 -179.278 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.521 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 40.2 t -64.91 -51.5 65.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.342 -0.844 . . . . 0.0 112.878 -178.042 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -64.0 -45.36 89.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.671 0.272 . . . . 0.0 111.519 -179.248 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.447 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 61.1 t80 -60.44 -22.55 63.56 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.68 -179.049 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.521 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.0 OUTLIER -55.13 -18.11 5.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.089 179.884 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -71.47 -1.3 12.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.813 179.691 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 4.0 m -145.45 32.75 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.443 -179.981 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.1 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.961 179.84 . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 mmt . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.818 0.342 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.8 -17.83 14.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.548 179.444 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 58.09 13.71 2.37 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.298 179.754 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -130.91 -0.04 4.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.514 179.87 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 -110.14 105.11 14.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.758 179.935 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -161.64 -9.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.688 -179.915 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 27.5 p-90 -126.5 25.88 6.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.712 -179.825 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.462 ' C ' ' H ' ' A' ' 10' ' ' ARG . 9.2 p -72.9 145.81 11.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.209 -179.915 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.494 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 38.1 ttm180 71.91 -18.92 0.29 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.627 179.661 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.493 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 29.5 mtp180 -62.96 104.09 0.52 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 178.439 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.493 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 15.9 m-20 70.65 12.19 7.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.449 -179.473 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.494 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 12.7 p -54.5 -54.04 25.67 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.606 -179.86 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.448 ' N ' HG11 ' A' ' 12' ' ' VAL . 34.9 t 51.95 -88.17 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.471 179.31 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 12' ' ' VAL . 32.3 p -70.5 172.31 8.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.583 179.453 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.69 -70.38 0.72 Allowed 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.183 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.459 HD13 ' N ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -87.88 -20.88 25.4 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.35 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.459 ' N ' HD13 ' A' ' 16' ' ' LEU . 34.0 m -71.86 -51.48 22.13 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.55 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.3 ttm180 -138.15 98.8 3.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.05 0.452 . . . . 0.0 111.682 -179.424 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.567 ' HG2' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -134.42 -42.96 0.77 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.784 179.519 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.429 ' N ' ' SD ' ' A' ' 19' ' ' MET . . . 95.47 -36.86 3.62 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.247 179.709 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -160.08 -16.58 0.06 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -179.348 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -67.64 -44.68 77.35 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -178.994 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.603 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -106.33 -0.47 24.27 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.654 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.568 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -52.25 -50.17 62.59 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.975 0.417 . . . . 0.0 110.463 179.553 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -63.36 -57.87 18.31 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.802 179.636 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.603 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 74.6 Cg_exo -43.73 -30.88 3.1 Favored 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 122.077 1.851 . . . . 0.0 111.554 179.795 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.568 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 36.6 mt -62.8 -56.85 13.75 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.354 178.918 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.482 HD23 ' HB2' ' A' ' 53' ' ' ARG . 0.9 OUTLIER -69.82 -19.6 63.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.126 179.515 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -73.33 -39.57 65.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.781 179.552 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.0 m -66.42 -7.18 17.7 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.116 179.778 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.479 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 96.4 mt -61.24 -19.87 62.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.914 0.388 . . . . 0.0 110.479 179.626 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 83.4 p -92.51 12.05 24.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.074 179.968 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -72.55 139.15 47.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.777 -179.762 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.39 -31.78 73.03 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.855 -179.942 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -77.39 147.97 35.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.495 179.782 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 25.8 p-90 -89.44 -40.24 12.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.463 -179.473 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -60.28 -25.52 65.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.913 0.387 . . . . 0.0 110.723 179.756 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.3 mm -81.08 -47.77 19.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.087 179.974 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.479 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 49.4 ttp180 -63.73 -22.08 66.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.877 179.901 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.452 ' HA2' ' HA ' ' A' ' 69' ' ' VAL . . . -69.04 -59.16 6.09 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.606 -179.885 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.26 -20.37 1.04 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.704 0.288 . . . . 0.0 111.597 180.0 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.86 -55.09 37.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.354 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.563 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -73.81 -25.47 60.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.175 -179.959 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.7 m95 -55.46 -36.95 67.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.211 -179.586 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.0 mt -100.1 -26.14 3.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.039 0.447 . . . . 0.0 111.128 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.563 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 0.9 OUTLIER -56.3 -46.61 81.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.34 -178.873 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.35 -21.61 60.08 Favored Glycine 0 CA--C 1.518 0.281 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.391 -179.058 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -70.71 -20.9 62.62 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 -179.064 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -92.08 -28.78 16.92 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.142 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.72 27.31 14.71 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 179.367 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.491 ' O ' HG23 ' A' ' 55' ' ' VAL . 12.0 t70 -96.12 170.03 9.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.767 0.317 . . . . 0.0 111.272 -179.866 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -54.12 -52.09 62.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.038 179.672 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.482 ' HB2' HD23 ' A' ' 28' ' ' LEU . 3.2 ptt180 -61.6 -8.47 4.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.225 179.66 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.487 ' HB3' HG23 ' A' ' 46' ' ' ILE . . . -104.97 -21.0 13.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.92 0.391 . . . . 0.0 111.067 -179.691 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 51' ' ' ASP . 69.5 t -73.58 -54.17 16.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.694 -179.633 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.435 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 25.5 tt0 -54.21 -47.7 96.57 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -179.527 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.494 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 97.2 Cg_exo -42.08 -46.92 7.02 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 122.489 2.126 . . . . 0.0 112.561 179.623 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.557 HD13 HD22 ' A' ' 77' ' ' LEU . 6.1 mt -63.48 -42.34 98.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.938 -179.592 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.0 mm -51.46 -54.84 10.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.345 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -70.06 -47.89 60.09 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.278 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.57 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.1 mp -60.17 -40.55 90.35 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.054 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.535 HD11 HD23 ' A' ' 77' ' ' LEU . 37.2 mt -56.77 -15.71 5.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.287 0.565 . . . . 0.0 109.999 -179.555 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -99.57 -30.98 11.83 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.293 178.235 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -62.21 87.77 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.174 178.957 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.467 ' HA ' ' NE ' ' A' ' 70' ' ' ARG . 16.6 m-20 -73.91 41.91 0.13 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.246 -178.798 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.9 t -85.75 -30.82 22.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.782 0.325 . . . . 0.0 111.125 179.763 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 126.46 -106.54 0.85 Allowed Glycine 0 C--O 1.228 -0.267 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.996 -179.686 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -46.7 -29.73 2.03 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.631 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.57 HG12 ' HG ' ' A' ' 61' ' ' LEU . 47.0 t -68.19 -54.98 18.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.963 179.559 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.467 ' NE ' ' HA ' ' A' ' 65' ' ' ASP . 0.2 OUTLIER -66.79 -54.69 20.07 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.257 179.736 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.3 m -50.95 -31.3 17.37 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.536 -179.614 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.46 -46.12 95.0 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.429 179.922 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.43 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -70.21 -32.94 71.06 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 -179.837 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.34 -61.53 2.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.817 0.342 . . . . 0.0 111.648 -179.189 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 75' ' ' ARG . 6.4 ptp180 -60.68 -20.48 61.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.746 -179.425 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.608 ' HA ' HE21 ' A' ' 79' ' ' GLN . 50.2 m -67.15 -36.03 80.96 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.27 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.557 HD22 HD13 ' A' ' 58' ' ' LEU . 4.2 mm? -54.81 -61.05 2.56 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.724 0.297 . . . . 0.0 111.416 179.748 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.469 ' HG2' ' HD1' ' A' ' 107' ' ' TYR . 37.6 mt-10 -56.36 -41.28 75.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.889 179.567 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.608 HE21 ' HA ' ' A' ' 76' ' ' SER . 20.3 mt-30 -62.32 -40.96 98.06 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -178.772 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 72.9 mt -60.74 -59.77 3.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -179.176 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.4 ' H ' HG21 ' A' ' 85' ' ' VAL . . . 174.59 -124.92 1.05 Allowed Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.09 -1.053 . . . . 0.0 113.392 179.938 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.455 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . -146.64 -66.67 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.411 -0.899 . . . . 0.0 113.748 -179.099 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.59 -27.08 63.83 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.335 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.482 ' HG2' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -85.05 -48.34 9.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.863 0.363 . . . . 0.0 110.517 -179.277 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.551 HG12 HD11 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -70.85 -20.77 22.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.723 178.858 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 1.4 tmm_? -47.28 -29.66 2.6 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.637 179.088 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.74 -36.84 50.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.75 179.963 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.91 -47.64 84.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.919 179.615 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 89' ' ' MET . . . . . 0.582 ' HE1' ' HG3' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -67.6 -30.29 69.84 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.509 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.582 ' HG3' ' HE1' ' A' ' 89' ' ' MET . 22.1 mt-10 -66.49 -33.89 76.71 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.122 179.171 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -70.72 -38.67 73.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.113 179.788 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.499 HD23 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -82.05 -23.66 35.74 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.652 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.31 -26.36 68.73 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.298 179.024 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -80.22 -26.76 38.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.708 179.887 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 58.3 p -112.54 23.02 14.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.171 178.54 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.446 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -56.07 116.1 6.92 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.064 -0.971 . . . . 0.0 113.508 -178.958 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.8 t -147.79 130.32 15.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.741 0.305 . . . . 0.0 110.72 179.05 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.07 -142.19 48.41 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.734 -179.833 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -62.54 -29.45 70.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 111.009 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.436 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -56.24 -37.63 70.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.505 -179.747 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.446 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 18.0 ttp180 -70.91 -55.55 8.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.622 -179.594 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 57.7 tttp -47.67 -23.18 0.63 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.163 0.506 . . . . 0.0 110.948 -179.872 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.429 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 17.8 t -68.4 -60.43 2.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.73 179.903 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.494 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.6 -56.28 24.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.38 -179.156 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.422 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 19.4 t -56.42 -63.17 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.026 -178.245 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 15.0 m120 -57.08 -27.72 61.99 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -178.674 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.469 ' HD1' ' HG2' ' A' ' 78' ' ' GLU . 4.4 t80 -59.83 -31.09 69.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.362 . . . . 0.0 110.359 179.768 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.453 HD22 ' HE2' ' A' ' 89' ' ' MET . 16.6 mt -52.65 -23.77 7.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.107 179.619 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -58.87 -8.75 1.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.215 179.747 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.5 p -93.19 -54.0 3.89 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.553 179.443 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 61.7 m80 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.322 -0.847 . . . . 0.0 110.932 179.843 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.438 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 CA--C 1.519 -0.215 0 CA-C-O 120.734 0.302 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.46 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 2.5 t80 -63.2 -51.57 65.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.244 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -63.4 -55.25 37.08 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.832 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.438 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 44.2 Cg_exo -50.91 -24.9 14.64 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 121.782 1.654 . . . . 0.0 110.349 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.666 HD21 HG13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -76.4 -41.75 46.77 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 114.207 -1.361 . . . . 0.0 109.218 178.912 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 31' ' ' LEU . 16.5 tp -70.47 -27.14 63.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.207 178.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -65.93 -41.11 91.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.124 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -61.38 -17.77 55.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.035 -0.53 . . . . 0.0 112.008 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 28' ' ' LEU . 80.1 mt -69.37 -11.89 61.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.788 0.328 . . . . 0.0 111.333 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.2 t -109.82 0.82 18.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.825 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -67.92 139.03 56.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.722 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -67.53 -24.03 65.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.315 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.67 139.79 33.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.919 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.1 p-90 -88.1 -26.4 22.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -64.08 -41.55 97.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.004 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.7 mt -80.18 -41.54 21.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.811 0.338 . . . . 0.0 111.122 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.536 ' HE ' HG21 ' A' ' 69' ' ' VAL . 54.1 ttp180 -59.48 -24.52 63.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.592 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.31 -63.61 3.85 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.635 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.61 -37.9 6.05 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.652 0.263 . . . . 0.0 111.258 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.438 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -57.45 -54.21 49.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.323 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.35 -30.81 71.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.703 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -68.47 -34.45 75.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.906 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.0 mt -99.37 -19.36 5.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.343 . . . . 0.0 111.762 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.666 HG13 HD21 ' A' ' 27' ' ' LEU . 3.9 tt -58.38 -34.92 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.24 -17.11 80.27 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.138 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -70.58 -7.15 41.87 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -99.18 -22.17 15.77 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.499 ' HG3' HG23 ' A' ' 80' ' ' ILE . 25.0 mp0 55.96 54.4 8.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 111.391 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -127.47 166.92 17.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.809 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -63.6 -29.11 70.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.663 ' HD2' HD22 ' A' ' 28' ' ' LEU . 1.1 ttp180 -66.33 -11.69 52.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.965 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.458 ' HA ' ' HG2' ' A' ' 57' ' ' PRO . . . -104.94 -13.59 15.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 86.8 t -68.9 -51.31 45.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.088 -179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.488 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 21.1 tt0 -59.75 -49.63 90.76 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.488 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.2 Cg_exo -41.22 -52.24 3.6 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.371 2.047 . . . . 0.0 112.898 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.627 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 5.2 mt -60.03 -36.93 78.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.384 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.6 mm -55.02 -59.83 2.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.875 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.44 ' HG3' HD13 ' A' ' 61' ' ' LEU . 3.9 ptpp? -70.76 -40.12 72.87 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.719 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -57.86 -51.58 69.03 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.465 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.799 HD13 HD22 ' A' ' 92' ' ' LEU . 33.5 mt -55.96 -10.34 0.77 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.716 0.294 . . . . 0.0 111.491 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.02 -20.32 13.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.991 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.419 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 6.5 m-20 -61.13 -40.3 93.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.714 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.446 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 29.5 t70 62.33 27.35 16.34 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.316 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.519 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 4.7 m -84.31 17.12 2.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.477 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.79 -96.58 0.68 Allowed Glycine 0 C--O 1.227 -0.337 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.747 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.09 -43.8 64.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.036 0.446 . . . . 0.0 110.61 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.719 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.8 t -73.35 -39.09 54.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.049 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.501 ' HG2' ' HA ' ' A' ' 62' ' ' LEU . 3.0 tmm_? -77.98 -63.6 1.35 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.668 0.27 . . . . 0.0 111.435 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 48.9 m -51.55 -32.25 27.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.305 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.438 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -63.4 -38.39 96.31 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.437 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.627 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -64.02 -37.37 87.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.704 0.288 . . . . 0.0 111.042 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.16 -57.14 14.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.762 -179.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 7.4 ptm85 -58.65 -26.93 64.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.618 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.2 m -58.49 -39.85 81.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.452 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.651 ' HA ' HG11 ' A' ' 85' ' ' VAL . 6.1 mp -59.79 -58.33 9.03 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.744 0.307 . . . . 0.0 110.631 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.456 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 54.1 mt-10 -48.96 -31.17 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.338 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.408 ' NE2' ' HG3' ' A' ' 75' ' ' ARG . 38.3 mt-30 -68.67 -41.93 78.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.141 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.499 HG23 ' HG3' ' A' ' 50' ' ' GLN . 35.3 mt -74.35 -60.87 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 63.14 117.6 0.01 OUTLIER Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.977 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.449 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 145.43 -173.05 25.98 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.753 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -69.45 -30.2 68.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.814 0.34 . . . . 0.0 110.902 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.553 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -52.85 -63.24 1.21 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.851 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.651 HG11 ' HA ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -70.93 -20.61 21.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.9 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 55.3 ttp180 -56.78 -26.35 57.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.253 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.16 -25.67 27.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.215 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.62 69.41 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.695 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.464 ' HB2' ' CB ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -69.09 -26.79 65.11 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.249 179.629 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 41.7 mt-10 -69.78 -32.26 70.64 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -76.76 -28.7 55.82 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.622 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.799 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -84.54 -30.08 25.39 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.515 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.57 -20.27 66.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.337 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -80.33 -26.86 38.54 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.674 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 51.3 p -118.2 24.4 10.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.827 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.425 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -55.85 116.41 7.19 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.338 -0.846 . . . . 0.0 113.261 -179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.3 t -140.52 130.24 24.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.828 0.347 . . . . 0.0 110.842 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.86 -135.67 51.79 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.631 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -67.64 -32.01 72.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.618 0.247 . . . . 0.0 111.315 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.548 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.84 -28.75 37.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.687 -179.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.425 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 21.9 ttp180 -75.22 -55.23 5.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.431 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -48.25 -26.95 2.19 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.21 0.529 . . . . 0.0 110.256 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.417 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 37.5 t -59.5 -60.04 3.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.868 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.62 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -62.59 -56.55 16.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.433 0.635 . . . . 0.0 111.957 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.589 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 54.8 t -52.38 -54.61 14.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 114.82 -1.082 . . . . 0.0 113.146 -178.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -70.74 -31.48 68.32 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.456 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 21.6 t80 -63.7 -50.96 67.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 4.3 pp -52.42 -15.02 0.55 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.456 -178.42 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -62.2 -13.71 30.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.088 0.47 . . . . 0.0 110.149 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.02 12.97 6.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.77 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.044 -0.979 . . . . 0.0 111.074 179.88 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.193 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.556 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -60.96 -53.86 52.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.154 0.502 . . . . 0.0 110.124 179.661 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -63.23 -54.92 40.97 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.013 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 91.9 Cg_exo -43.33 -26.38 0.93 Allowed 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.228 1.952 . . . . 0.0 111.458 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.556 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 43.5 mt -74.68 -55.3 6.03 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.937 178.591 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.608 HD12 HD11 ' A' ' 31' ' ' LEU . 38.1 tp -61.53 -20.96 63.81 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.599 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -80.68 -36.81 31.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.715 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.479 ' HB3' HG22 ' A' ' 38' ' ' ILE . 60.0 m -66.22 -42.42 88.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.859 -179.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.608 HD11 HD12 ' A' ' 28' ' ' LEU . 4.1 pp -63.32 -6.27 4.46 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.2 m -90.32 22.12 3.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.066 0.46 . . . . 0.0 110.525 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -117.5 144.58 44.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.029 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -65.89 -8.76 23.96 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.305 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -77.36 120.69 22.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.947 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -70.68 -35.88 73.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.827 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 53.1 ttp180 -60.11 -54.63 43.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.254 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.479 HG22 ' HB3' ' A' ' 30' ' ' SER . 64.0 mt -65.96 -45.65 90.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.804 0.335 . . . . 0.0 111.0 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.499 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.3 ttm180 -63.2 -20.69 65.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.58 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.65 -66.48 2.27 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.625 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.6 -40.31 19.03 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.688 0.28 . . . . 0.0 111.18 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.99 -52.72 63.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.075 0.464 . . . . 0.0 110.235 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.448 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -63.31 -36.19 82.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.665 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -63.16 -26.28 68.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.471 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 62.8 mt -99.26 -19.74 5.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.005 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.589 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.9 OUTLIER -55.39 -39.54 53.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.535 -179.738 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.19 -16.48 73.17 Favored Glycine 0 C--N 1.329 0.193 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.744 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.0 -45.93 86.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.831 0.348 . . . . 0.0 110.379 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.443 ' C ' ' H ' ' A' ' 51' ' ' ASP . 85.2 m-85 -85.54 111.87 20.41 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.659 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.544 ' HG3' HG23 ' A' ' 80' ' ' ILE . 13.7 mp0 -74.67 35.02 0.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.377 179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.443 ' H ' ' C ' ' A' ' 49' ' ' PHE . 35.6 t70 -100.66 155.31 17.96 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.84 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.488 ' O ' HG12 ' A' ' 55' ' ' VAL . 12.2 pt-20 -63.06 -23.58 67.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.544 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.459 ' HD3' HD22 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -57.69 -41.15 81.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.81 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.589 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -97.37 24.55 6.41 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 52' ' ' GLU . 2.7 p -91.41 -37.75 9.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.941 0.4 . . . . 0.0 111.062 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.521 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 24.8 tt0 -60.45 -51.13 82.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.98 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.571 ' HG2' HG12 ' A' ' 46' ' ' ILE . 88.5 Cg_exo -42.81 -52.36 4.67 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.397 2.065 . . . . 0.0 112.761 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.59 HD13 HD23 ' A' ' 77' ' ' LEU . 49.6 mt -56.73 -41.23 77.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.596 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 25.3 mm -53.17 -60.12 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -71.87 -31.04 66.06 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.63 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -66.08 -44.19 85.15 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.657 HD13 HD11 ' A' ' 92' ' ' LEU . 12.0 mt -62.68 -8.96 7.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.967 0.413 . . . . 0.0 110.564 -178.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -126.95 -6.2 6.15 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.27 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.43 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 3.7 t70 -61.17 -33.05 72.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.28 0.562 . . . . 0.0 110.745 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 42.7 m-20 58.75 25.75 13.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.292 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.454 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.1 m -86.04 5.59 32.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.623 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.98 -103.95 2.63 Favored Glycine 0 C--O 1.227 -0.306 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.44 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -50.44 -39.79 48.58 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.182 0.515 . . . . 0.0 110.127 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.63 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.4 t -67.98 -38.29 79.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.539 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 27.0 ttp180 -76.61 -58.87 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.294 -179.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 62.0 p -50.87 -30.18 13.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.326 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.17 -37.02 94.23 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.616 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.455 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -77.08 -36.92 55.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.61 0.243 . . . . 0.0 111.507 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.45 ' HB2' ' HE1' ' A' ' 99' ' ' PHE . . . -54.98 -49.59 71.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.799 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 7.3 ptp180 -73.68 -33.8 64.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.283 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 19.8 m -56.5 -39.97 74.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.034 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.59 HD23 HD13 ' A' ' 58' ' ' LEU . 90.1 mt -55.51 -59.58 4.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.747 0.308 . . . . 0.0 110.53 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -49.08 -29.99 5.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.804 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 20.2 mt-30 -68.68 -41.71 78.86 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.949 0.404 . . . . 0.0 110.257 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.544 HG23 ' HG3' ' A' ' 50' ' ' GLN . 71.6 mt -69.22 -61.48 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.12 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.405 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 58.94 111.3 0.01 OUTLIER Glycine 0 CA--C 1.518 0.27 0 C-N-CA 121.156 -0.545 . . . . 0.0 113.155 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.415 ' H ' ' HB3' ' A' ' 111' ' ' HIS . . . 165.83 174.26 35.15 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.593 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.93 -22.59 66.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.834 0.349 . . . . 0.0 110.547 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.601 ' HD3' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -75.76 -33.7 60.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.619 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.601 ' N ' ' HD3' ' A' ' 84' ' ' ARG . 3.4 t -68.53 -32.68 56.29 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-O 121.333 0.587 . . . . 0.0 109.756 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 86' ' ' ARG . 9.3 ttt180 -52.48 -26.61 13.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.777 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.29 -41.61 66.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.503 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.04 -43.07 88.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.116 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.437 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.98 -36.27 77.67 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.786 0.327 . . . . 0.0 110.387 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.62 -31.38 72.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.078 0.466 . . . . 0.0 109.976 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -65.59 -39.1 91.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.85 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.69 HD12 ' HB2' ' A' ' 104' ' ' ALA . 29.4 mt -70.94 -40.23 72.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.562 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.46 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -55.79 -22.34 23.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.937 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -92.26 -23.43 19.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.978 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 71.5 p -121.64 39.01 3.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.822 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.413 ' CA ' ' HD3' ' A' ' 101' ' ' ARG . . . -38.42 104.67 0.03 OUTLIER Glycine 0 C--N 1.332 0.353 0 CA-C-N 115.761 -0.654 . . . . 0.0 113.611 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.2 p -144.8 132.18 20.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.838 0.351 . . . . 0.0 110.927 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.69 -143.58 46.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.477 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.45 ' HE1' ' HB2' ' A' ' 74' ' ' ALA . 10.6 p90 -84.16 -24.29 30.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.698 0.285 . . . . 0.0 110.819 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.624 ' HB1' HD13 ' A' ' 92' ' ' LEU . . . -44.9 -36.8 3.51 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.47 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.46 ' NE ' ' HA ' ' A' ' 93' ' ' ALA . 14.1 tpt180 -64.3 -61.88 1.96 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -54.46 -33.37 59.51 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.201 0.524 . . . . 0.0 110.261 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 43.3 t -65.19 -44.7 95.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.075 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.69 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -64.99 -59.02 4.63 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 61.1 t -55.15 -62.68 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.612 -178.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -55.46 -38.21 68.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.723 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.405 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 9.5 t80 -58.82 -44.66 90.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.906 0.384 . . . . 0.0 111.644 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.436 ' O ' HD12 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -51.1 -17.74 0.7 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.026 -178.522 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -61.11 -8.94 3.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 111.004 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 56.1 p -122.29 -41.8 2.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.179 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.415 ' HB3' ' H ' ' A' ' 82' ' ' GLY . 71.6 m80 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.809 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.423 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.675 0.274 . . . . 0.0 111.703 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.462 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 2.5 t80 -60.63 -46.54 89.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.508 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.42 -54.08 47.0 Favored Pre-proline 0 N--CA 1.466 0.329 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.431 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.423 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 53.0 Cg_exo -46.32 -23.88 2.28 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.902 1.735 . . . . 0.0 111.011 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.657 HD21 HG13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -83.96 -46.83 11.65 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 114.322 -1.308 . . . . 0.0 110.128 179.667 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.676 HD12 HD12 ' A' ' 31' ' ' LEU . 15.1 tp -69.13 -16.93 63.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.363 179.147 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -75.61 -36.57 60.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.771 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.4 m -66.34 -20.28 66.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.825 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.676 HD12 HD12 ' A' ' 28' ' ' LEU . 91.2 mt -65.86 -9.52 29.82 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.574 0.226 . . . . 0.0 111.542 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.5 m -101.5 11.69 38.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.079 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -71.47 148.04 47.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.018 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.43 -18.28 65.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.965 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -86.76 162.48 17.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.791 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -102.86 -39.62 6.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.798 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -58.74 -37.5 76.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.894 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.2 mm -61.59 -41.57 90.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.717 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.441 ' HB2' HG22 ' A' ' 69' ' ' VAL . 76.4 mtt180 -62.45 -24.5 67.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.398 179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.62 -64.36 3.63 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.858 -0.686 . . . . 0.0 112.197 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.74 -33.8 36.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.781 0.324 . . . . 0.0 110.948 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.34 -55.46 15.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.583 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.421 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -62.62 -26.01 68.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.742 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.435 ' NE1' ' HA2' ' A' ' 72' ' ' GLY . 5.3 m95 -70.63 -32.82 70.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.135 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.534 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 41.4 mt -99.46 -22.88 4.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.945 0.403 . . . . 0.0 111.41 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.657 HG13 HD21 ' A' ' 27' ' ' LEU . 4.4 tt -61.02 -37.56 77.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.19 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -78.08 -14.8 81.9 Favored Glycine 0 C--N 1.33 0.216 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.221 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.534 ' ND2' ' HA ' ' A' ' 45' ' ' ILE . 51.0 m-20 -70.74 -14.76 62.56 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -93.76 -10.31 34.67 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.454 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.7 OUTLIER 50.51 61.54 3.16 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.815 0.341 . . . . 0.0 111.412 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -127.93 161.68 28.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.164 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.69 -36.15 82.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.723 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -65.71 -9.06 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.046 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.462 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -102.99 -13.67 16.79 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.866 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 41.7 t -72.15 -38.87 64.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.439 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.503 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 26.4 tt0 -57.07 -51.51 81.15 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.624 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.508 ' HG2' HD13 ' A' ' 46' ' ' ILE . 89.6 Cg_exo -41.97 -51.64 4.5 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.261 1.974 . . . . 0.0 112.156 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.448 HD23 ' HG ' ' A' ' 77' ' ' LEU . 8.4 mp -52.69 -37.5 59.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.961 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.2 mm -56.58 -61.44 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -72.4 -10.41 59.76 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.505 ' HA ' ' HB2' ' A' ' 64' ' ' ASP . 1.8 mp -89.37 -49.39 6.73 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.615 HD13 HD22 ' A' ' 92' ' ' LEU . 11.4 mt -56.45 -15.52 4.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.851 0.358 . . . . 0.0 111.181 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -113.71 -11.82 12.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.505 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.7 OUTLIER -61.08 -46.09 92.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.056 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.591 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 14.4 t70 63.08 24.45 14.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.152 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.468 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.6 m -86.2 7.58 24.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.012 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.89 -108.47 3.52 Favored Glycine 0 C--O 1.229 -0.204 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.425 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -48.81 -30.9 6.25 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.257 0.551 . . . . 0.0 109.634 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 66' ' ' SER . 58.8 t -72.08 -50.81 34.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.783 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.591 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 38.3 ttp180 -68.2 -62.45 1.39 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.108 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.5 m -51.04 -27.67 8.52 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.957 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.435 ' HA2' ' NE1' ' A' ' 44' ' ' TRP . . . -57.84 -56.2 26.44 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.73 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.442 ' CB ' ' HA ' ' A' ' 58' ' ' LEU . . . -56.2 -46.15 79.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.854 0.359 . . . . 0.0 110.907 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.12 -27.18 63.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.775 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.414 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 27.3 ttt-85 -83.8 -34.6 24.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.814 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.463 ' HA ' HE21 ' A' ' 79' ' ' GLN . 47.5 m -61.98 -39.47 92.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.621 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.464 HD23 HG22 ' A' ' 85' ' ' VAL . 1.1 mt -59.25 -59.24 5.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.717 0.294 . . . . 0.0 111.411 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -48.93 -38.86 24.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.706 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.463 HE21 ' HA ' ' A' ' 76' ' ' SER . 41.4 mt-30 -70.81 -47.79 57.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.628 0.251 . . . . 0.0 111.37 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.581 HG21 ' HB ' ' A' ' 85' ' ' VAL . 90.0 mt -61.43 -60.63 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.36 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 53.88 70.55 0.9 Allowed Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.579 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -152.45 164.71 30.7 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.552 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -65.17 -27.64 68.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.848 0.356 . . . . 0.0 110.859 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.512 ' CD ' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -69.28 -50.99 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.875 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.581 ' HB ' HG21 ' A' ' 80' ' ' ILE . 9.9 p -70.77 -23.87 24.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.272 0.558 . . . . 0.0 110.331 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -53.46 -29.99 38.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.806 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 91' ' ' LYS . . . -65.87 -31.41 72.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.267 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.07 -51.38 69.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.968 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.552 ' HE3' ' O ' ' A' ' 104' ' ' ALA . 3.4 ppp? -69.72 -24.87 63.63 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.822 0.344 . . . . 0.0 110.387 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.432 ' N ' ' SD ' ' A' ' 89' ' ' MET . 28.2 mt-10 -68.17 -40.16 82.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.967 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 46.4 mmtm -78.78 -21.71 47.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.119 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.615 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -86.69 -30.33 21.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.786 0.327 . . . . 0.0 110.207 179.779 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.19 -26.81 67.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.975 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -80.11 -25.64 39.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.083 0.468 . . . . 0.0 110.288 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.2 p -117.4 24.42 11.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.349 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.472 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -58.24 121.68 27.04 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.153 -179.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 92.3 m -139.69 130.42 25.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.57 -0.315 . . . . 0.0 110.76 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.32 -133.8 52.6 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.759 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.54 ' O ' HG23 ' A' ' 103' ' ' VAL . 48.0 t80 -66.41 -33.78 76.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.787 0.327 . . . . 0.0 111.146 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.576 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.28 -38.69 54.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.014 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.472 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 39.9 ttt180 -70.44 -60.02 2.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.811 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -46.57 -25.2 0.65 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.155 0.503 . . . . 0.0 110.749 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 99' ' ' PHE . 37.1 t -67.7 -60.52 2.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.259 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.552 ' O ' ' HE3' ' A' ' 89' ' ' MET . . . -50.36 -59.65 3.77 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.5 t -58.4 -64.27 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -55.56 -38.34 69.21 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.42 ' HB3' ' O ' ' A' ' 103' ' ' VAL . 12.1 t80 -58.84 -48.19 82.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.867 0.365 . . . . 0.0 111.445 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -21.48 6.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.807 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -54.98 -21.3 11.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.864 0.364 . . . . 0.0 110.992 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.9 p -95.25 -49.11 5.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.146 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 73.4 m80 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.865 -179.98 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 -0.076 0 CA-C-O 120.824 0.345 . . . . 0.0 110.938 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.559 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -57.21 -50.83 71.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.702 -179.422 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.503 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.38 -55.71 33.25 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.634 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.503 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 87.6 Cg_exo -45.56 -27.81 3.8 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 122.093 1.862 . . . . 0.0 111.438 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 47.5 mt -71.17 -50.16 36.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.845 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.614 HD12 HD12 ' A' ' 31' ' ' LEU . 10.4 tp -73.08 -18.41 61.31 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.448 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -81.53 -39.52 24.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.389 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.5 t -66.39 -10.83 47.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.729 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.614 HD12 HD12 ' A' ' 28' ' ' LEU . 58.4 mt -63.51 -21.08 66.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.711 0.291 . . . . 0.0 111.116 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.9 p -104.52 8.77 35.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.844 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -64.65 150.37 47.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.149 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -67.86 -44.43 77.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.829 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -77.73 133.52 38.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.003 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.1 m0 -79.71 -22.44 43.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.675 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -61.99 -48.31 80.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.47 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.6 mt -75.46 -37.61 38.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.666 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.543 ' HG2' ' HA ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -61.64 -32.65 72.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.225 179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.44 -57.38 7.47 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.307 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.21 -29.18 1.48 Allowed 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 120.798 0.332 . . . . 0.0 111.287 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.67 -54.85 42.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.366 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.79 -29.29 70.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.673 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -65.29 -34.41 78.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.242 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 29.1 mt -101.05 -20.82 5.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.855 0.359 . . . . 0.0 111.599 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.568 HD13 ' HG2' ' A' ' 57' ' ' PRO . 1.3 tt -60.42 -36.89 72.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.84 -8.23 72.32 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.244 -0.979 . . . . 0.0 112.703 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -70.78 -22.75 62.34 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.568 0.21 . . . . 0.0 111.568 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -88.24 -32.86 18.32 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.722 0.268 . . . . 0.0 111.722 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.595 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 35.6 mt-30 66.22 19.04 11.06 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.593 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -86.11 169.41 13.15 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.759 0.314 . . . . 0.0 110.804 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.67 -36.82 85.52 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.613 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 32.0 ttm180 -68.05 -9.88 49.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.815 0.34 . . . . 0.0 111.066 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -104.15 4.54 34.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.165 0.507 . . . . 0.0 110.41 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.3 t -91.12 -33.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.7 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.555 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.4 tm-20 -60.21 -50.24 86.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.766 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.568 ' HG2' HD13 ' A' ' 46' ' ' ILE . 82.4 Cg_exo -46.86 -49.4 12.46 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.304 2.003 . . . . 0.0 112.471 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.516 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 6.6 mt -58.84 -28.25 65.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.716 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.8 mm -63.38 -61.3 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 64' ' ' ASP . 21.8 ttpt -72.02 -39.17 69.36 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.609 ' HG ' HG12 ' A' ' 69' ' ' VAL . 2.4 mp -55.54 -51.32 67.46 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -178.107 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.496 HD11 HD21 ' A' ' 77' ' ' LEU . 49.9 mt -62.19 -10.19 9.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.109 0.48 . . . . 0.0 110.358 -179.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -113.91 -15.06 12.41 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.025 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' A' ' 60' ' ' LYS . 10.3 t0 -61.09 -47.72 84.98 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.383 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.507 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 5.7 m-20 62.55 28.15 16.57 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.458 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.455 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 48.1 t -84.8 -16.99 39.58 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 111.089 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 113.98 -104.82 1.5 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.026 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.16 -28.26 10.63 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.46 0.648 . . . . 0.0 109.301 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.609 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.8 t -73.67 -54.99 13.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.812 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.507 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 32.7 ttp180 -66.94 -61.52 1.9 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.047 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.0 t -52.06 -31.56 30.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.933 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.34 -35.33 90.8 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.321 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.516 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -84.68 -23.43 29.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.741 0.305 . . . . 0.0 111.045 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.407 ' O ' HD12 ' A' ' 77' ' ' LEU . . . -58.51 -52.87 63.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.153 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.537 ' H ' ' HG3' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -79.44 -17.28 54.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.012 179.847 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.514 ' HB2' HH21 ' A' ' 75' ' ' ARG . 48.3 t -63.48 -45.94 88.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.886 0.374 . . . . 0.0 110.497 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.602 HD13 ' HE1' ' A' ' 89' ' ' MET . 0.4 OUTLIER -56.84 -57.44 12.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.227 179.56 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -55.21 -34.45 63.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.53 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -68.73 -23.78 64.39 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.964 0.412 . . . . 0.0 110.16 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.595 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 57.2 mt -81.95 -61.02 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.447 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 56.6 92.82 0.01 OUTLIER Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.718 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 173.26 172.13 38.51 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.595 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -63.69 -26.45 68.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.834 0.35 . . . . 0.0 110.948 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.561 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -61.78 -57.46 11.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.826 -179.684 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.478 HG21 ' HA ' ' A' ' 77' ' ' LEU . 9.9 p -70.68 -23.7 24.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.648 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.44 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 3.2 tmt_? -51.35 -33.46 29.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.375 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.18 -32.46 56.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.642 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.14 -36.5 73.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.748 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.629 ' HE2' ' HA ' ' A' ' 104' ' ' ALA . 1.6 mmm -69.8 -53.47 18.1 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.317 -0.401 . . . . 0.0 109.93 179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -54.22 -29.13 45.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.298 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -76.87 -32.08 57.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.55 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.549 HD23 ' HB2' ' A' ' 104' ' ' ALA . 1.3 tp -86.74 -29.44 22.37 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.936 0.398 . . . . 0.0 110.427 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.25 -31.77 65.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.887 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -80.16 -24.71 40.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.319 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.7 p -118.35 33.09 5.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.555 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.441 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -48.23 124.79 11.68 Favored Glycine 0 N--CA 1.449 -0.44 0 CA-C-N 114.951 -1.022 . . . . 0.0 114.085 -178.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 20.2 m -143.33 130.31 20.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.493 -0.354 . . . . 0.0 110.162 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 65.74 -142.41 43.65 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.347 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -81.6 -22.23 37.83 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.709 0.29 . . . . 0.0 110.933 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.49 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -49.92 -41.08 45.28 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.909 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.441 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 61.6 ttt180 -56.14 -60.88 2.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.739 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -54.69 -25.92 30.25 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.562 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.6 t -72.4 -50.83 32.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.742 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.629 ' HA ' ' HE2' ' A' ' 89' ' ' MET . . . -53.26 -55.53 23.76 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.8 t -60.81 -61.78 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.724 -178.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.424 ' HA ' ' OE2' ' A' ' 109' ' ' GLU . 93.8 m-20 -56.35 -36.33 68.65 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -61.91 -30.74 71.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.963 0.411 . . . . 0.0 111.232 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.5 mt -56.27 -15.95 4.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.977 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.424 ' OE2' ' HA ' ' A' ' 106' ' ' ASN . 0.5 OUTLIER -75.23 1.21 14.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.434 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 61.4 p -111.81 -61.6 1.68 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.742 0.306 . . . . 0.0 111.023 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.814 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.585 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 120.974 0.416 . . . . 0.0 110.416 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 4.6 t80 -57.85 -60.19 4.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.406 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.527 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -63.51 -53.32 52.84 Favored Pre-proline 0 N--CA 1.466 0.328 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.863 -178.989 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.585 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 9.7 Cg_endo -51.56 -25.41 19.47 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 121.777 1.652 . . . . 0.0 110.513 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.624 HD21 HD13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -75.77 -40.59 55.0 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.128 178.064 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.632 HD22 ' HD3' ' A' ' 53' ' ' ARG . 6.1 tp -73.84 -20.46 60.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.137 177.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 25' ' ' GLU . 3.2 tm-20 -77.69 -40.97 39.66 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.599 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.481 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 67.7 m -61.76 -19.55 62.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.263 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.523 HD12 HD12 ' A' ' 28' ' ' LEU . 79.1 mt -66.85 -9.35 36.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.729 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.0 t -109.6 18.9 19.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.872 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.481 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 89.1 m-20 -85.36 135.12 34.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.939 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -58.56 -25.51 62.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.786 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -83.67 153.69 24.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.729 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -104.89 -25.88 12.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -63.01 -36.59 84.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.867 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.5 mt -81.19 -36.94 15.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.8 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -63.91 -31.84 73.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -56.6 -57.08 21.29 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.354 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.34 -38.82 59.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.691 0.281 . . . . 0.0 110.977 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.43 -50.62 71.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.383 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.433 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -65.24 -35.29 80.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.745 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.4 m95 -66.1 -32.13 73.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.926 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.7 mm -99.41 -23.14 4.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.624 HD13 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -54.52 -37.82 39.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -178.536 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -67.68 -19.51 71.25 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.867 -0.682 . . . . 0.0 113.769 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -70.69 -0.89 9.72 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -101.64 -26.26 13.58 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.491 ' HG2' HG23 ' A' ' 80' ' ' ILE . 57.8 mt-30 62.11 18.3 9.9 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -93.43 167.84 11.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.614 0.245 . . . . 0.0 110.692 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -62.32 -31.8 72.47 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.812 0.339 . . . . 0.0 110.684 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.632 ' HD3' HD22 ' A' ' 28' ' ' LEU . 34.4 ttm180 -69.2 -9.52 53.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.011 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.439 ' HA ' HD12 ' A' ' 46' ' ' ILE . . . -100.24 -7.54 24.54 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.207 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.4 t -91.14 -39.18 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.577 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.543 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 21.5 tt0 -60.51 -50.85 83.7 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.543 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 89.1 Cg_exo -47.8 -45.73 23.43 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.11 1.874 . . . . 0.0 112.029 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.63 HD22 ' HA ' ' A' ' 73' ' ' ALA . 4.6 mt -57.95 -31.47 66.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.639 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.407 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 50.9 mm -57.41 -61.54 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -11.75 60.79 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.684 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.3 mp -84.85 -49.63 8.24 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.176 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.715 HD13 HD22 ' A' ' 92' ' ' LEU . 8.8 mt -59.4 -10.05 2.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.17 0.51 . . . . 0.0 110.289 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 59' ' ' ILE . 8.2 pt-20 -115.42 -17.22 11.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.18 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -61.07 -32.81 72.45 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.151 0.501 . . . . 0.0 110.943 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.622 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 1.5 m-20 50.4 30.08 4.33 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.722 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.488 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 47.5 t -85.94 2.41 46.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.776 0.322 . . . . 0.0 111.094 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.28 -89.13 1.6 Allowed Glycine 0 C--O 1.228 -0.244 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.694 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -58.76 -38.55 78.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.932 0.396 . . . . 0.0 110.224 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.684 HG12 ' HG ' ' A' ' 61' ' ' LEU . 14.3 t -73.77 -49.23 36.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.233 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.622 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 45.9 ttp180 -62.48 -58.3 8.12 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.927 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 33.4 t -51.96 -26.76 11.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.771 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -60.12 -39.77 96.27 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.542 -0.837 . . . . 0.0 111.544 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.63 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -71.26 -49.96 37.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.847 0.356 . . . . 0.0 110.42 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.97 -25.69 58.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.274 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -84.16 -32.46 24.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.502 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.9 m -67.08 -44.78 79.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.008 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.555 ' HA ' HG21 ' A' ' 85' ' ' VAL . 2.5 mp -55.67 -59.64 4.56 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.513 -179.437 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -49.28 -36.14 19.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.714 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -66.07 -57.87 6.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.812 0.339 . . . . 0.0 111.186 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.491 HG23 ' HG2' ' A' ' 50' ' ' GLN . 92.0 mt -53.92 -60.34 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.412 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 59.73 88.45 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.41 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 175.12 172.46 40.06 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.48 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -65.91 -22.48 66.51 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.747 0.308 . . . . 0.0 111.267 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.548 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -63.37 -62.84 1.41 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.472 -179.836 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.555 HG21 ' HA ' ' A' ' 77' ' ' LEU . 3.4 p -70.85 -21.18 22.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.728 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -50.66 -46.38 58.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.376 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.32 -24.0 26.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.061 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 85' ' ' VAL . . . -71.46 -42.55 68.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.402 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.57 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -71.88 -30.82 65.8 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.446 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.7 -39.27 88.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.649 179.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -77.57 -23.0 50.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.131 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.715 HD22 HD13 ' A' ' 62' ' ' LEU . 1.2 tp -85.99 -26.98 25.14 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.34 -24.09 66.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.412 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -80.29 -26.49 38.88 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.411 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 64.3 p -117.01 20.23 13.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.556 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.488 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -53.7 121.74 19.35 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 115.095 -0.957 . . . . 0.0 113.27 -179.106 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.8 m -142.67 130.13 21.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.79 0.328 . . . . 0.0 110.835 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 57.84 -129.34 49.39 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.845 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.475 ' O ' HG23 ' A' ' 103' ' ' VAL . 57.2 t80 -70.25 -35.04 73.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.727 0.299 . . . . 0.0 111.204 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.59 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -52.0 -35.96 48.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.049 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.488 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 45.4 ttt180 -72.21 -57.27 4.38 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -48.28 -21.99 0.6 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.122 0.487 . . . . 0.0 110.762 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 99' ' ' PHE . 32.4 t -68.35 -60.4 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.645 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.587 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -54.75 -54.75 37.9 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.282 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.502 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 57.4 t -59.02 -61.38 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.586 -178.267 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -56.1 -37.92 70.05 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -58.73 -29.19 66.51 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.502 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -51.51 -28.96 14.97 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -75.22 6.78 3.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.662 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.5 m -100.22 -61.13 1.41 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.685 0.279 . . . . 0.0 111.465 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.94 -179.749 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.508 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.23 0.064 0 CA-C-O 121.148 0.499 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.535 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.0 t80 -61.76 -40.9 96.76 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.306 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.31 -55.56 34.97 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.469 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.508 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 65.9 Cg_exo -38.16 -29.57 0.14 Allowed 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 122.655 2.237 . . . . 0.0 112.124 178.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.569 HD13 HG13 ' A' ' 46' ' ' ILE . 28.4 mt -66.46 -58.67 4.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.39 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 31' ' ' LEU . 24.3 tp -66.74 -20.18 65.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.201 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -79.35 -34.64 41.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.849 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.53 ' HB3' HG22 ' A' ' 38' ' ' ILE . 75.6 m -65.77 -24.68 66.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.46 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 28' ' ' LEU . 82.5 mt -61.63 -12.06 14.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.791 0.329 . . . . 0.0 110.988 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.5 m -91.13 20.32 5.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.135 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -103.91 138.94 39.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.901 0.381 . . . . 0.0 111.258 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -67.75 -15.53 63.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.679 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.413 ' HB3' HD12 ' A' ' 38' ' ' ILE . 17.1 t70 -76.12 152.18 36.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.107 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 15.5 m0 -95.7 -36.14 11.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.095 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.4 ' HD2' ' O ' ' A' ' 37' ' ' ARG . 5.0 tmm_? -58.85 -38.2 78.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.187 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.53 HG22 ' HB3' ' A' ' 30' ' ' SER . 41.0 mt -75.11 -34.52 31.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.721 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -60.7 -55.85 28.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.276 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.3 -57.12 21.52 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.954 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.73 -36.24 4.87 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.766 0.317 . . . . 0.0 111.509 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.475 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.77 -53.33 57.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.044 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.32 -25.77 63.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.606 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.4 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 7.1 m95 -60.36 -42.54 95.98 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.681 0.622 . . . . 0.0 112.681 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.6 mm -99.35 -23.59 4.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.638 HD13 ' HG2' ' A' ' 57' ' ' PRO . 5.6 tt -59.87 -33.95 54.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -178.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.58 -27.13 69.21 Favored Glycine 0 CA--C 1.518 0.22 0 C-N-CA 120.707 -0.759 . . . . 0.0 113.254 -179.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -70.73 0.72 6.47 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -94.67 -27.41 15.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.66 ' HG3' ' HA ' ' A' ' 80' ' ' ILE . 14.9 mp0 62.35 26.04 15.55 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.234 0.54 . . . . 0.0 110.778 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.407 ' O ' HG23 ' A' ' 55' ' ' VAL . 2.9 m-20 -102.57 166.31 10.59 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.121 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -65.56 -34.83 79.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.16 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.525 ' HG3' HD22 ' A' ' 28' ' ' LEU . 34.2 ttm180 -67.34 -10.02 46.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.56 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -104.82 0.36 28.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.633 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 51' ' ' ASP . 57.4 t -90.69 -50.16 13.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.541 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.549 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.3 tm-20 -58.62 -49.38 93.77 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.958 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.638 ' HG2' HD13 ' A' ' 46' ' ' ILE . 72.8 Cg_exo -49.83 -27.44 15.75 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.32 2.013 . . . . 0.0 112.762 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.666 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 23.4 mt -74.23 -54.1 8.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.097 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.476 ' HA ' HD12 ' A' ' 62' ' ' LEU . 44.7 mm -49.66 -48.21 20.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.875 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -70.02 -30.16 67.4 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 -179.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.639 ' HG ' HG12 ' A' ' 69' ' ' VAL . 4.1 tp -89.82 -17.99 27.09 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.631 HD13 HD22 ' A' ' 92' ' ' LEU . 14.1 mt -70.43 -14.38 62.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.016 0.436 . . . . 0.0 110.828 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -115.12 6.75 15.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.03 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -61.11 -32.21 71.9 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.244 0.545 . . . . 0.0 110.841 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.511 ' HB2' HH21 ' A' ' 70' ' ' ARG . 18.8 t70 55.32 23.72 5.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.066 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.52 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 31.0 t -86.29 -26.01 25.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.84 0.353 . . . . 0.0 110.693 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 125.34 -109.36 1.18 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.485 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.4 ' HD1' ' NE1' ' A' ' 44' ' ' TRP . 0.1 OUTLIER -56.93 -24.33 51.72 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.253 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.639 HG12 ' HG ' ' A' ' 61' ' ' LEU . 39.9 t -68.59 -36.53 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.798 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.511 HH21 ' HB2' ' A' ' 65' ' ' ASP . 19.5 ttm180 -78.45 -51.17 10.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.726 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.1 m -58.02 -37.7 74.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.078 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.09 -51.34 50.87 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.224 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.666 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -67.34 -34.02 76.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.934 0.397 . . . . 0.0 110.703 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.528 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -55.48 -61.58 2.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.952 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -57.17 -27.71 62.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.019 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.425 ' O ' HG13 ' A' ' 80' ' ' ILE . 49.0 m -61.63 -29.92 70.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.76 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.567 HD11 HD11 ' A' ' 62' ' ' LEU . 8.3 mp -55.57 -61.34 2.41 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.711 0.291 . . . . 0.0 111.517 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.43 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 6.1 pt-20 -61.31 -24.99 66.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.997 0.427 . . . . 0.0 110.558 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -70.67 -23.95 62.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.234 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.66 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 91.6 mt -81.83 -60.38 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.571 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . 174.93 -130.94 1.85 Allowed Glycine 0 C--N 1.334 0.433 0 C-N-CA 119.962 -1.113 . . . . 0.0 113.805 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.473 ' H ' ' HD2' ' A' ' 84' ' ' ARG . . . -140.89 -72.89 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.768 -0.729 . . . . 0.0 113.623 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -60.9 -25.5 66.78 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.596 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -86.2 -50.71 6.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.675 0.274 . . . . 0.0 111.038 -179.361 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.538 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -70.84 -20.86 22.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.474 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 68.5 ttt180 -49.57 -30.4 8.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.522 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.42 -32.23 54.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.144 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.14 -51.48 37.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.941 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.511 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 4.1 ppp? -64.19 -25.68 68.18 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.548 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -70.21 -37.83 75.14 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -69.7 -28.91 66.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.476 179.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.631 HD22 HD13 ' A' ' 62' ' ' LEU . 1.4 tp -87.57 -27.53 22.51 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.961 0.41 . . . . 0.0 110.123 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.17 -30.97 71.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.253 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.466 ' HG3' HG23 ' A' ' 95' ' ' THR . 12.1 pt-20 -80.22 -22.99 41.21 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 121.088 0.47 . . . . 0.0 109.758 179.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.466 HG23 ' HG3' ' A' ' 94' ' ' GLU . 52.3 p -108.9 13.16 24.98 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.491 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.79 113.94 4.41 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 114.957 -1.019 . . . . 0.0 113.028 -179.137 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 39.4 m -140.31 130.09 24.48 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.474 -0.363 . . . . 0.0 110.868 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.69 -126.65 42.56 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.638 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.404 ' O ' HG23 ' A' ' 103' ' ' VAL . 59.5 t80 -73.52 -34.23 65.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.674 0.273 . . . . 0.0 111.263 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.468 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.63 -33.27 54.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.983 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.491 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 29.7 ttt180 -72.39 -56.07 6.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.365 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -48.72 -22.94 0.88 Allowed 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.182 0.515 . . . . 0.0 110.602 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.44 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 33.0 t -67.07 -55.04 19.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.646 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.541 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -61.97 -57.07 13.11 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.564 HG13 ' H ' ' A' ' 106' ' ' ASN . 5.2 p -59.65 -58.65 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.096 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.564 ' H ' HG13 ' A' ' 105' ' ' VAL . 4.8 t30 -56.72 -30.12 63.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.709 0.29 . . . . 0.0 111.31 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.51 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 1.2 t80 -58.96 -35.18 72.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.128 0.489 . . . . 0.0 110.308 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.8 mt -53.05 -14.37 0.6 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.898 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.01 6.23 11.95 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.7 p -121.59 -63.49 1.31 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.667 0.27 . . . . 0.0 111.506 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 23.6 p80 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 117.946 -1.026 . . . . 0.0 111.573 -179.784 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.846 0.355 . . . . 0.0 111.415 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.452 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 2.3 t80 -63.42 -45.19 92.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.153 0.501 . . . . 0.0 110.817 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.467 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 7.2 mm-40 -63.41 -56.04 30.34 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.536 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.2 Cg_endo -55.6 -14.52 10.26 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 121.712 1.608 . . . . 0.0 110.643 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.561 HD21 HG13 ' A' ' 46' ' ' ILE . 1.4 tp -86.47 -40.26 15.48 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.373 -1.285 . . . . 0.0 109.212 178.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.586 HD12 HD12 ' A' ' 31' ' ' LEU . 31.8 tp -75.15 -22.49 58.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.297 179.093 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -69.0 -29.68 67.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.612 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 63.8 m -65.09 -27.71 68.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.41 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.586 HD12 HD12 ' A' ' 28' ' ' LEU . 40.7 mt -65.78 -11.35 45.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.172 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.0 m -100.68 16.38 25.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.645 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -88.93 145.51 25.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -67.79 -27.77 67.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.866 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -75.84 146.21 40.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.933 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 12.2 p90 -87.38 -32.91 19.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.2 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.95 -32.12 73.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.923 0.392 . . . . 0.0 110.37 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.9 mm -81.32 -41.01 18.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.294 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.456 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 40.9 ttm180 -64.06 -48.34 76.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.58 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -57.95 -49.55 73.83 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.791 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.09 -26.98 12.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.642 0.258 . . . . 0.0 111.46 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' O ' HD11 ' A' ' 27' ' ' LEU . . . -62.82 -56.69 15.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.71 0.29 . . . . 0.0 111.049 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.411 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -65.81 -28.84 69.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.049 0.452 . . . . 0.0 110.777 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.2 m95 -57.01 -39.49 74.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.481 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.8 mt -98.35 -25.73 3.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.772 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.561 HG13 HD21 ' A' ' 27' ' ' LEU . 3.5 tt -57.93 -20.99 15.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.361 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.86 -27.56 64.49 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.692 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -60.29 -30.46 69.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.715 0.293 . . . . 0.0 111.018 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -104.69 106.01 16.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.555 ' HG2' HG23 ' A' ' 80' ' ' ILE . 2.5 mt-30 -66.93 80.0 0.12 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.08 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -128.18 156.72 42.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.006 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.41 -28.58 69.35 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.927 0.394 . . . . 0.0 110.989 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -69.31 -9.52 53.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.757 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.471 ' HB2' HG12 ' A' ' 46' ' ' ILE . . . -104.85 15.4 27.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.62 -179.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 56.5 t -91.55 -58.1 3.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.118 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.485 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 17.5 tt0 -56.49 -48.87 96.29 Favored Pre-proline 0 CA--C 1.531 0.216 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.527 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 86.0 Cg_exo -42.12 -48.1 6.54 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.396 2.064 . . . . 0.0 112.527 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.61 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 7.5 mt -62.13 -44.7 96.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.065 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 50.0 mm -53.66 -58.89 2.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.192 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.46 ' HZ1' ' HB3' ' A' ' 31' ' ' LEU . 3.7 pttt -70.16 -18.93 63.22 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.017 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.717 ' HG ' HG12 ' A' ' 69' ' ' VAL . 2.9 tp -89.52 -32.71 17.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.746 HD13 HD11 ' A' ' 92' ' ' LEU . 14.2 mt -64.82 -10.49 28.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.127 0.489 . . . . 0.0 110.381 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -114.26 -2.18 13.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.113 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -61.21 -30.23 70.3 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.134 0.493 . . . . 0.0 111.055 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 54.39 27.15 7.77 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.913 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.504 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.4 t -85.0 -19.36 32.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.943 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 119.86 -110.25 1.78 Allowed Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.48 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -56.92 -26.28 58.95 Favored 'General case' 0 CA--C 1.521 -0.155 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.717 HG12 ' HG ' ' A' ' 61' ' ' LEU . 15.5 t -68.24 -34.11 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.879 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.401 ' NH1' ' HA3' ' A' ' 98' ' ' GLY . 60.1 ttp180 -78.44 -40.85 34.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.838 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 97.3 p -67.03 -38.88 86.7 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.478 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.459 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -53.33 -55.23 25.61 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.6 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.61 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -55.72 -32.72 63.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.786 0.327 . . . . 0.0 111.457 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.432 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.78 -63.89 1.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.581 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 72' ' ' GLY . 0.3 OUTLIER -53.62 -32.64 52.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.341 -179.843 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.9 t -56.2 -40.28 73.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 110.865 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.618 HD11 HD11 ' A' ' 62' ' ' LEU . 20.0 mt -62.76 -58.52 7.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -50.4 -35.62 29.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.732 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.67 -37.35 86.08 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.068 0.461 . . . . 0.0 110.148 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.555 HG23 ' HG2' ' A' ' 50' ' ' GLN . 95.1 mt -72.8 -60.27 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.792 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 59.49 98.88 0.01 OUTLIER Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.803 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.534 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 172.99 -169.73 42.88 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.617 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -72.03 -30.27 65.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.93 0.395 . . . . 0.0 110.777 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.573 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.1 OUTLIER -59.51 -50.47 73.77 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.004 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.564 HG12 HD23 ' A' ' 77' ' ' LEU . 16.5 m -70.74 -25.35 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.002 0.429 . . . . 0.0 110.739 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.439 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -55.77 -27.92 53.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.466 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.22 -34.64 32.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.755 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.08 -49.47 76.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.891 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.596 ' HE2' ' HA ' ' A' ' 104' ' ' ALA . 3.2 mmm -60.17 -46.79 88.5 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -53.3 -32.56 49.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.071 178.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -73.67 -31.37 63.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.848 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.746 HD11 HD13 ' A' ' 62' ' ' LEU . 25.6 mt -76.53 -38.65 54.76 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.85 0.357 . . . . 0.0 110.606 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.456 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -53.21 -32.45 48.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.068 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -84.82 -19.98 31.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.695 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.8 p -122.41 38.37 4.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.55 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -41.94 117.36 1.26 Allowed Glycine 0 C--N 1.334 0.434 0 CA-C-N 115.741 -0.663 . . . . 0.0 113.353 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.4 t -157.45 136.31 11.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.822 0.344 . . . . 0.0 111.091 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.401 ' HA3' ' NH1' ' A' ' 70' ' ' ARG . . . 60.16 -144.96 46.79 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.417 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -91.81 -14.55 29.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.792 0.33 . . . . 0.0 110.457 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -53.99 -35.64 62.08 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.231 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.456 ' NE ' ' HA ' ' A' ' 93' ' ' ALA . 13.9 tpt180 -67.53 -55.8 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.095 179.078 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -48.53 -28.11 3.16 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.727 178.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.2 t -78.03 -44.51 27.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.805 -1.088 . . . . 0.0 111.343 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.596 ' HA ' ' HE2' ' A' ' 89' ' ' MET . . . -54.89 -57.92 9.68 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -178.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.439 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 42.2 t -61.06 -58.59 6.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.326 -178.231 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -56.51 -42.8 78.98 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.466 ' OH ' HG21 ' A' ' 85' ' ' VAL . 43.1 t80 -62.03 -28.33 69.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.811 0.339 . . . . 0.0 111.606 -178.068 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 46.5 mt -58.08 -11.87 2.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.627 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -80.21 4.97 15.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.75 0.309 . . . . 0.0 111.07 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.2 p -140.64 -69.97 0.39 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.207 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.007 -0.996 . . . . 0.0 111.567 179.876 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.494 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.692 0.282 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.524 ' CZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.0 OUTLIER -50.07 -49.78 50.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.315 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.27 -52.55 60.57 Favored Pre-proline 0 N--CA 1.466 0.374 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.822 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.494 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 71.6 Cg_exo -35.03 -34.75 0.1 Allowed 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 122.453 2.102 . . . . 0.0 112.172 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.448 HD13 ' O ' ' A' ' 23' ' ' ALA . 8.4 mp -73.79 -55.3 6.4 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.01 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -50.36 -37.46 37.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.52 178.9 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -66.62 -32.62 74.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.86 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.7 m -64.92 -13.75 57.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.117 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.471 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 87.7 mt -68.72 -19.81 64.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.897 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 56.7 m -93.36 7.64 43.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.92 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -79.92 128.1 33.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.669 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -58.88 -23.51 61.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.613 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -75.85 149.19 37.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.778 0.323 . . . . 0.0 110.565 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 38.4 p-90 -94.43 -37.95 11.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.442 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -63.69 -42.27 98.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.788 0.328 . . . . 0.0 111.036 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.6 mt -67.56 -44.61 86.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.867 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.471 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.4 ttm180 -63.31 -23.48 67.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.576 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.33 -61.0 6.07 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.48 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.14 -36.31 8.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.733 0.301 . . . . 0.0 111.402 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.418 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.56 -54.71 39.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.906 0.384 . . . . 0.0 110.861 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.4 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -64.8 -30.5 71.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.327 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.3 m95 -70.8 -31.2 67.88 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 61.7 mt -99.6 -27.02 3.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.873 0.368 . . . . 0.0 111.648 -178.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.683 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.1 tt -60.85 -28.88 44.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.699 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.543 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -69.89 -4.06 46.13 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.937 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -69.82 -40.22 76.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.755 0.312 . . . . 0.0 110.196 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.465 ' C ' ' H ' ' A' ' 51' ' ' ASP . 11.9 m-85 -91.33 119.42 31.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.738 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.459 ' HA ' HD12 ' A' ' 80' ' ' ILE . 1.9 mt-30 -72.78 25.85 0.06 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.48 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.465 ' H ' ' C ' ' A' ' 49' ' ' PHE . 29.2 t70 -83.98 155.33 22.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.908 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -59.07 -33.0 70.29 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.329 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -67.63 -11.96 59.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.865 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.641 ' O ' HD13 ' A' ' 58' ' ' LEU . . . -105.91 -8.45 17.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.036 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 59' ' ' ILE . 96.4 t -91.52 -30.16 4.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.418 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.557 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 17.3 tt0 -60.27 -50.52 85.57 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.683 ' HG2' HD13 ' A' ' 46' ' ' ILE . 74.5 Cg_exo -49.32 -52.37 8.91 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.924 1.75 . . . . 0.0 111.859 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.687 HD23 ' HG ' ' A' ' 77' ' ' LEU . 5.1 mp -56.04 -27.17 52.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.881 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 55' ' ' VAL . 40.4 mm -63.35 -59.54 4.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.739 0.304 . . . . 0.0 111.379 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -70.04 -22.79 63.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.521 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.747 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -65.37 -51.94 57.04 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.941 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.772 HD13 HD22 ' A' ' 92' ' ' LEU . 9.1 mt -51.93 -21.58 3.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.351 . . . . 0.0 111.304 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -104.24 -18.36 14.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.107 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.414 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 8.3 t0 -59.65 -36.06 75.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 111.144 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.482 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 24.7 t70 52.19 30.28 7.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.229 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.488 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.3 t -80.07 -3.07 47.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.217 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.87 -81.56 1.6 Allowed Glycine 0 C--O 1.228 -0.238 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.944 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.64 -47.15 82.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.2 0.524 . . . . 0.0 109.649 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.747 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.2 t -69.04 -45.44 80.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.46 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.482 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 7.0 tmm_? -64.32 -62.45 1.6 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.873 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.7 m -54.07 -30.14 47.01 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.975 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.72 -39.85 94.13 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.41 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.403 ' HA ' ' HG ' ' A' ' 58' ' ' LEU . . . -67.9 -38.85 83.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.638 0.256 . . . . 0.0 111.363 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.63 -54.23 24.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.3 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.436 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 4.0 ptp180 -67.96 -42.94 80.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.002 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.543 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 74.6 m -59.21 -31.06 68.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.742 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.695 HD22 HG13 ' A' ' 85' ' ' VAL . 69.6 mt -70.67 -60.46 2.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.975 -179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -59.87 -22.51 62.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.147 0.499 . . . . 0.0 110.293 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.436 ' HB2' ' O ' ' A' ' 75' ' ' ARG . 41.2 tt0 -56.9 -37.49 71.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.56 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.459 HD12 ' HA ' ' A' ' 50' ' ' GLN . 32.2 mm -71.56 -60.22 2.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.963 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.44 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 69.45 80.31 0.26 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.296 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -176.69 179.1 47.85 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.391 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -63.44 -22.39 66.86 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.823 0.345 . . . . 0.0 110.971 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.56 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -62.07 -59.88 4.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.355 -179.598 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.695 HG13 HD22 ' A' ' 77' ' ' LEU . 74.8 t -69.64 -24.09 26.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.94 0.4 . . . . 0.0 110.638 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.427 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 2.7 tmt_? -56.65 -27.44 58.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.072 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -82.67 -31.8 28.46 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.769 0.319 . . . . 0.0 111.079 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.79 -34.51 75.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.422 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.57 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 7.0 mmt -71.17 -47.57 56.91 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.414 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -57.74 -29.85 65.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.031 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -80.07 -32.7 39.29 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.935 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.772 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -80.81 -26.08 37.37 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.022 0.439 . . . . 0.0 109.847 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.02 -21.67 65.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.526 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -80.22 -27.21 38.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.675 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.1 p -118.44 24.27 11.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.387 178.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.43 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -56.85 119.65 16.59 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.549 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.4 t -144.58 130.4 19.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.836 0.351 . . . . 0.0 110.894 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.44 -130.08 11.84 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.824 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -87.0 -26.51 23.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.571 0.225 . . . . 0.0 111.267 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.652 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.42 -37.49 62.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.859 0.362 . . . . 0.0 111.5 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.43 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 35.4 ttp180 -66.56 -58.46 5.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.707 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 57.9 tttp -46.23 -24.31 0.45 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.191 0.52 . . . . 0.0 110.79 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 45.2 t -71.93 -59.74 3.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.634 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.738 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -56.34 -51.79 66.95 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 15.5 t -62.27 -63.74 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -55.36 -39.3 69.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.57 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 31.0 t80 -61.57 -31.73 71.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 120.808 0.337 . . . . 0.0 111.441 -178.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 58.5 mt -57.38 -12.19 2.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.61 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.86 -12.2 60.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.865 0.364 . . . . 0.0 110.993 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 73.0 p -113.7 -62.62 1.57 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.309 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.152 -0.927 . . . . 0.0 110.805 -179.971 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.509 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.458 -0.054 0 CA-C-O 120.605 0.24 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.4 t80 -60.61 -48.59 81.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.969 0.414 . . . . 0.0 110.243 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.406 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 18.9 mt-10 -63.45 -56.99 22.03 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.965 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.509 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 88.0 Cg_exo -43.04 -28.82 1.38 Allowed 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.365 2.043 . . . . 0.0 111.624 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 65.3 mt -68.76 -55.02 12.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.298 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.554 HD12 HD12 ' A' ' 31' ' ' LEU . 18.7 tp -67.88 -18.82 64.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.513 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -79.04 -42.8 25.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.964 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.1 p -66.48 -13.7 61.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.395 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.554 HD12 HD12 ' A' ' 28' ' ' LEU . 87.3 mt -67.51 -7.4 25.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.244 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.8 p -95.7 15.33 20.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.561 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -95.01 136.93 34.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -67.3 -1.87 5.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.025 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -84.59 153.24 23.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.77 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.4 p-90 -104.43 -38.64 6.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.954 0.407 . . . . 0.0 110.53 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.454 ' HG3' HG13 ' A' ' 38' ' ' ILE . 13.7 ptm180 -62.82 -39.03 93.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.79 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.454 HG13 ' HG3' ' A' ' 37' ' ' ARG . 50.8 mt -79.36 -47.99 21.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.934 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.488 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 38.3 ttm180 -63.5 -28.51 70.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.601 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.69 -59.02 6.37 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.423 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.14 -29.63 22.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.741 0.305 . . . . 0.0 110.976 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.67 -55.49 23.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.479 ' O ' HG22 ' A' ' 46' ' ' ILE . . . -69.48 -22.89 63.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.193 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.1 m95 -66.12 -28.31 68.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.614 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.8 mt -99.6 -23.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.71 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.479 HG22 ' O ' ' A' ' 43' ' ' ALA . 0.6 OUTLIER -61.08 -32.69 53.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.503 -179.248 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.62 -16.58 63.52 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.552 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.97 -27.04 65.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.837 0.351 . . . . 0.0 110.681 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -99.05 112.77 24.81 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.801 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -77.98 36.58 0.23 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.817 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.416 ' O ' HG23 ' A' ' 55' ' ' VAL . 33.9 t70 -95.37 165.53 12.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.992 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.48 -31.31 72.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.518 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.444 ' HB3' ' CE2' ' A' ' 24' ' ' PHE . 41.5 ttm180 -69.17 -14.15 62.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.425 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.37 5.19 31.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.031 0.444 . . . . 0.0 110.641 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.651 ' HA ' ' NH2' ' A' ' 84' ' ' ARG . 98.9 t -87.03 -46.9 16.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.804 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.466 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 34.2 tt0 -60.34 -48.25 94.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.466 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 81.0 Cg_exo -42.14 -52.09 4.36 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.405 2.07 . . . . 0.0 112.817 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 73' ' ' ALA . 6.8 mt -60.62 -37.0 79.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.333 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.9 mm -55.21 -59.43 2.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.477 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.19 -15.77 62.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.24 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.788 HD23 ' H ' ' A' ' 73' ' ' ALA . 0.4 OUTLIER -74.14 -52.66 11.85 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -178.892 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.52 HD13 HD22 ' A' ' 92' ' ' LEU . 7.9 mt -57.06 -10.34 1.12 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.306 -179.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -111.99 -13.44 13.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.618 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.413 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 52.8 m-20 -61.14 -32.23 71.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.799 0.333 . . . . 0.0 111.78 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.511 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 32.9 m-20 48.26 32.12 2.98 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.07 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.47 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 29.3 t -83.07 -24.42 32.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.494 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.43 -85.39 0.39 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.95 -0.643 . . . . 0.0 111.556 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.89 -42.43 99.77 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.679 HG12 ' HG ' ' A' ' 61' ' ' LEU . 13.6 t -69.33 -56.86 10.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.056 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.511 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 7.3 tmm_? -54.67 -51.65 64.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.544 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.6 m -63.96 -19.92 65.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.377 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.49 -65.12 3.65 Favored Glycine 0 C--O 1.228 -0.222 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.572 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.788 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -49.77 -31.23 11.06 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.63 -46.54 73.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.788 0.328 . . . . 0.0 111.35 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 6.8 ptp180 -82.23 -24.45 34.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.853 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.405 ' HA ' ' OE1' ' A' ' 79' ' ' GLN . 49.6 m -63.52 -38.94 93.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.512 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.6 mt -58.92 -59.96 4.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.137 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.458 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 38.8 mt-10 -46.23 -32.67 3.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.132 179.035 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 96.1 mt-30 -70.81 -41.5 71.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.348 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.499 HD13 ' HE ' ' A' ' 84' ' ' ARG . 59.9 mt -75.28 -61.43 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.86 -179.117 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.64 168.51 2.36 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.673 -0.775 . . . . 0.0 113.006 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.58 -170.59 24.4 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.895 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -64.89 -24.48 67.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.156 0.503 . . . . 0.0 110.419 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.651 ' NH2' ' HA ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER -54.83 -62.37 1.7 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.63 179.719 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.528 HG21 ' OH ' ' A' ' 107' ' ' TYR . 16.1 m -63.22 -24.75 36.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.27 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.534 ' HA ' ' HE1' ' A' ' 89' ' ' MET . 0.2 OUTLIER -54.62 -33.36 60.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.366 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.21 -24.27 24.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.713 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.43 ' HB2' ' NH1' ' A' ' 84' ' ' ARG . . . -70.27 -49.06 53.72 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.534 ' HE1' ' HA ' ' A' ' 86' ' ' ARG . 0.7 OUTLIER -70.18 -30.51 67.65 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.639 0.257 . . . . 0.0 110.888 -179.14 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -69.8 -43.4 72.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.7 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -67.91 -28.99 67.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.716 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.52 HD22 HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -86.33 -27.84 24.06 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.999 179.702 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.9 -22.91 65.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.578 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -80.23 -26.67 38.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.494 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 59.8 p -122.65 23.58 9.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.374 0.606 . . . . 0.0 109.471 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.559 ' HA3' ' HG2' ' A' ' 101' ' ' ARG . . . -58.31 124.94 38.02 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 115.036 -0.984 . . . . 0.0 113.128 -179.153 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.412 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 2.3 t -141.23 130.15 23.13 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.72 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 62.63 -140.18 45.85 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.406 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.483 ' O ' HG23 ' A' ' 103' ' ' VAL . 62.2 t80 -62.07 -35.5 78.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.758 0.313 . . . . 0.0 110.66 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.504 ' HB2' ' HD3' ' A' ' 70' ' ' ARG . . . -54.44 -36.53 64.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.253 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.559 ' HG2' ' HA3' ' A' ' 96' ' ' GLY . 1.3 tmt_? -68.83 -61.78 1.66 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.466 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -52.11 -22.53 4.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.295 -179.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 99' ' ' PHE . 5.1 t -67.07 -53.15 36.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.536 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.453 ' O ' HD23 ' A' ' 108' ' ' LEU . . . -54.81 -62.61 1.54 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.068 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.5 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 23.5 t -54.78 -57.67 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.397 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.14 -32.5 66.43 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.528 ' OH ' HG21 ' A' ' 85' ' ' VAL . 34.9 t80 -63.3 -25.35 68.27 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 120.759 0.314 . . . . 0.0 111.161 -178.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.8 mm? -50.91 -26.89 6.46 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.01 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -53.91 -13.58 0.79 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.36 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 34.7 p -119.75 -87.49 0.64 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.305 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.418 ' HB2' HG21 ' A' ' 85' ' ' VAL . 15.7 m-70 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.952 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.895 0.378 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 51' ' ' ASP . 0.4 OUTLIER -52.62 -48.27 66.47 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.021 179.464 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.526 ' HG3' ' NH1' ' A' ' 53' ' ' ARG . 3.6 mt-10 -62.21 -57.02 25.68 Favored Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 1.9 Cg_endo -50.72 -19.18 4.85 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.996 1.797 . . . . 0.0 111.498 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.505 HD21 ' HA ' ' A' ' 46' ' ' ILE . 0.8 OUTLIER -81.63 -39.91 23.72 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.697 179.367 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 31' ' ' LEU . 10.8 tp -80.26 -22.15 41.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.364 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -73.95 -34.63 64.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.626 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.0 m -66.17 -17.19 64.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.12 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 28' ' ' LEU . 51.3 mt -68.23 -6.59 24.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.862 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.1 m -103.19 11.24 37.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.758 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -71.1 142.15 50.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.821 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -59.51 -34.53 72.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.346 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -81.4 144.33 31.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.973 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.1 p90 -87.3 -32.8 19.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.016 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -58.77 -35.62 73.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.468 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.2 mm -80.83 -41.4 19.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.492 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.531 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 29.5 ttm180 -63.26 -20.02 65.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.629 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.81 -62.88 3.58 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.707 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.62 -33.04 2.64 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.644 0.259 . . . . 0.0 111.438 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.438 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.02 -52.75 63.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.916 0.389 . . . . 0.0 110.085 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.496 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -64.47 -28.71 69.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.74 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -66.97 -36.69 82.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.124 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.1 mm -99.29 -22.29 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.505 ' HA ' HD21 ' A' ' 27' ' ' LEU . 4.2 tt -61.04 -38.94 80.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -178.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.75 -6.59 17.87 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.256 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -70.59 -49.77 44.22 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -65.69 -26.81 67.94 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.508 ' HG2' HG12 ' A' ' 80' ' ' ILE . 2.0 mt-30 61.07 16.29 6.97 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.783 0.325 . . . . 0.0 111.4 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 55' ' ' VAL . 18.9 t70 -84.11 -178.72 7.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.033 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -61.54 -37.24 83.06 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -179.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.609 ' HB3' HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -67.19 -10.6 52.14 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.888 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.98 -9.42 17.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.975 0.417 . . . . 0.0 111.273 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 51' ' ' ASP . 62.5 t -82.02 -47.88 18.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.934 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.481 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 4.7 tp10 -60.1 -48.31 94.76 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.5 ' HG2' HD13 ' A' ' 46' ' ' ILE . 83.9 Cg_exo -43.0 -53.07 4.26 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.289 1.993 . . . . 0.0 112.664 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.613 HD13 HD22 ' A' ' 77' ' ' LEU . 16.3 mt -53.54 -34.22 57.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.046 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 42.9 mm -63.29 -61.15 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.503 ' HG3' HD13 ' A' ' 61' ' ' LEU . 16.8 pttt -72.19 -19.09 61.8 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.675 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -77.77 -51.1 11.07 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.617 HD11 HD21 ' A' ' 77' ' ' LEU . 69.4 mt -63.43 -9.01 10.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.225 0.536 . . . . 0.0 109.972 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -112.94 -16.23 12.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.478 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.459 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.9 OUTLIER -61.09 -54.44 44.61 Favored 'General case' 0 CA--C 1.517 -0.288 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.307 -179.571 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 12.5 t70 72.02 25.5 3.02 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.738 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 69.0 m -81.21 -4.92 57.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.993 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.53 -101.84 2.45 Favored Glycine 0 C--O 1.229 -0.193 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.656 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.16 -30.46 37.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.262 0.553 . . . . 0.0 109.928 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.675 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.0 t -73.6 -46.83 46.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.198 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -70.46 -60.51 2.22 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.686 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.6 m -54.16 -28.34 39.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.872 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.88 -37.74 94.85 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.447 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.421 ' O ' HD23 ' A' ' 77' ' ' LEU . . . -79.8 -37.08 36.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.653 0.263 . . . . 0.0 110.987 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -46.26 -35.06 4.89 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.157 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.416 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 1.2 ptp85 -83.91 -33.51 24.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.652 0.263 . . . . 0.0 111.453 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.4 m -57.84 -37.43 73.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.891 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.617 HD21 HD11 ' A' ' 62' ' ' LEU . 4.1 mm? -55.33 -61.22 2.48 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 110.95 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -65.25 -24.69 67.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.677 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 75' ' ' ARG . 10.8 tt0 -60.89 -58.49 8.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.8 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.607 HD12 HG13 ' A' ' 85' ' ' VAL . 95.4 mt -63.29 -52.02 63.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.101 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 55.39 76.43 0.19 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.663 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -174.68 -179.76 45.48 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.598 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -59.64 -21.48 60.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.951 0.405 . . . . 0.0 110.699 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.612 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 1.2 mpt_? -59.7 -64.33 0.98 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.333 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.607 HG13 HD12 ' A' ' 80' ' ' ILE . 0.0 OUTLIER -70.84 -20.59 22.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.931 179.351 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -52.88 -33.09 48.42 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.933 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.55 -26.34 35.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.441 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.17 -45.0 64.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.008 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.556 ' HE3' ' HG2' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -68.88 -29.77 68.13 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.488 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.556 ' HG2' ' HE3' ' A' ' 89' ' ' MET . 10.1 mm-40 -70.82 -31.32 68.01 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.077 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -74.45 -31.4 62.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.191 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.56 HD21 ' O ' ' A' ' 100' ' ' ALA . 1.7 tp -86.55 -32.23 20.81 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.776 0.322 . . . . 0.0 110.172 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -54.91 -28.06 47.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.162 0.506 . . . . 0.0 110.265 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -83.21 -25.46 31.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.205 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 54.2 p -116.12 32.08 6.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.008 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.565 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -46.51 121.41 5.66 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.307 -0.86 . . . . 0.0 113.771 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.0 m -150.47 130.71 13.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.777 0.322 . . . . 0.0 110.403 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.9 -139.72 28.97 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.348 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -89.6 -18.48 26.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.824 0.345 . . . . 0.0 110.367 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.604 ' HB1' ' HB3' ' A' ' 62' ' ' LEU . . . -54.18 -43.96 71.14 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.594 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.565 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 55.4 ttp180 -51.84 -57.95 7.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.31 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -56.55 -32.15 64.86 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.094 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.56 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 18.9 t -64.14 -41.83 93.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.227 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.516 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -64.51 -57.18 9.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.056 0.455 . . . . 0.0 111.872 -179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.523 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 6.3 p -64.93 -54.26 31.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.879 -178.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.516 ' N ' HG13 ' A' ' 105' ' ' VAL . 5.1 t30 -55.55 -34.36 64.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.588 0.232 . . . . 0.0 111.404 -179.123 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.449 ' OH ' HG23 ' A' ' 85' ' ' VAL . 5.6 t80 -58.83 -31.68 68.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.46 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.523 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -49.96 -20.29 0.89 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.53 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -69.08 5.06 1.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.449 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.8 m -108.48 -72.51 0.72 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.711 0.291 . . . . 0.0 111.329 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 84.4 t60 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.735 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.586 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.183 0 CA-C-O 120.922 0.392 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.3 t80 -62.26 -40.43 96.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 121.315 0.578 . . . . 0.0 109.526 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.513 ' HG2' ' NH1' ' A' ' 53' ' ' ARG . 43.2 mt-10 -63.41 -56.2 28.92 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.881 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.586 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 77.2 Cg_exo -37.2 -29.23 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.24 0 C-N-CA 122.639 2.226 . . . . 0.0 111.695 179.026 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 81.7 mt -72.68 -58.41 3.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.588 178.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.544 ' HA ' HD12 ' A' ' 31' ' ' LEU . 49.1 tp -61.27 -24.88 66.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.783 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -79.1 -44.6 21.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.765 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.5 p -65.54 -11.73 46.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.0 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.547 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 43.5 mt -70.21 -6.84 37.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.129 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 77.7 p -111.98 13.89 20.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.776 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -69.09 147.67 51.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.017 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -56.82 -44.12 81.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.395 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -75.85 163.27 27.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.055 0.455 . . . . 0.0 111.388 -179.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -103.72 -29.59 10.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.737 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -63.53 -32.97 74.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.218 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.3 mt -81.16 -41.8 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.847 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.547 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 32.7 ttm180 -61.75 -29.8 70.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.724 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -56.11 -63.25 5.48 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.348 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.27 -29.28 9.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.545 0.212 . . . . 0.0 111.479 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.56 -52.08 59.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.873 0.368 . . . . 0.0 110.531 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.431 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -67.01 -31.35 71.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.687 179.248 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -70.7 -28.29 64.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.254 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 81.2 mt -98.76 -27.99 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.841 0.353 . . . . 0.0 111.655 -179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.594 HD13 ' HG2' ' A' ' 57' ' ' PRO . 1.5 tt -60.31 -30.36 46.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.827 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.42 -20.8 63.81 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.939 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.8 m-20 -65.79 -23.85 66.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.846 0.355 . . . . 0.0 110.445 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.489 ' C ' ' H ' ' A' ' 51' ' ' ASP . 9.1 m-85 -95.29 109.5 21.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.486 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -71.85 16.66 0.11 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.3 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.489 ' H ' ' C ' ' A' ' 49' ' ' PHE . 37.1 t70 -84.04 161.56 20.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.641 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.91 -28.7 69.13 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.552 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.513 ' NH1' ' HG2' ' A' ' 25' ' ' GLU . 12.7 ttm180 -63.91 -13.95 49.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.024 0.44 . . . . 0.0 110.489 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.19 -10.61 16.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.486 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.429 HG13 ' HB2' ' A' ' 88' ' ' ALA . 68.2 t -82.23 -36.11 13.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.625 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.559 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 3.8 tp10 -60.37 -49.97 87.96 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.274 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.594 ' HG2' HD13 ' A' ' 46' ' ' ILE . 82.8 Cg_exo -45.14 -51.27 7.89 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.287 1.991 . . . . 0.0 111.892 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.754 HD13 HD22 ' A' ' 77' ' ' LEU . 4.8 mt -54.73 -35.04 63.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.624 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.558 HG23 ' HD2' ' A' ' 91' ' ' LYS . 46.2 mm -60.77 -60.76 2.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.822 0.344 . . . . 0.0 111.566 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -71.48 -10.85 60.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.103 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.75 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.7 mp -88.62 -48.05 7.83 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.692 HD13 HD22 ' A' ' 92' ' ' LEU . 26.5 mt -60.32 -12.31 8.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.971 0.415 . . . . 0.0 110.798 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -113.93 -11.97 12.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.816 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -61.12 -44.95 96.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.101 0.477 . . . . 0.0 111.089 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.63 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 28.5 m-20 66.93 22.22 10.17 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.944 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.513 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 39.6 m -86.38 16.06 4.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.637 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.08 -100.27 0.84 Allowed Glycine 0 C--O 1.227 -0.319 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.857 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -46.86 -40.97 14.97 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.076 0.465 . . . . 0.0 110.741 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.75 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.4 t -71.26 -51.11 36.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.45 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.63 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 53.7 ttp180 -62.3 -60.64 3.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.22 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 88.5 p -53.98 -34.13 58.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.993 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.48 -26.71 57.31 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.056 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.5 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -88.12 -39.77 14.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.787 0.327 . . . . 0.0 110.878 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.07 -34.99 59.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.099 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -80.66 -23.97 39.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.937 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.6 m -67.07 -39.07 86.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.291 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.754 HD22 HD13 ' A' ' 58' ' ' LEU . 4.2 mm? -55.36 -57.02 13.58 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.826 0.345 . . . . 0.0 110.565 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.91 -34.75 78.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.363 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -56.37 -44.61 80.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.254 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.409 HD12 ' CG1' ' A' ' 85' ' ' VAL . 92.2 mt -78.22 -59.73 2.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.853 0.359 . . . . 0.0 110.752 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.61 97.77 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.599 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.437 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 170.16 -177.48 43.44 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.484 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -68.83 -30.97 69.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.572 0.225 . . . . 0.0 110.972 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.538 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.57 -53.22 60.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.821 0.343 . . . . 0.0 110.438 179.732 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.538 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -70.82 -24.07 24.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.267 179.311 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.444 HH11 ' HD2' ' A' ' 86' ' ' ARG . 18.1 ttt180 -58.84 -38.09 77.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.419 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.32 -22.86 59.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.757 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.429 ' HB2' HG13 ' A' ' 55' ' ' VAL . . . -71.52 -46.83 58.54 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.993 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.603 ' HE2' ' HB3' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -72.23 -32.69 66.94 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.6 179.701 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.534 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 27.1 mt-10 -59.16 -41.46 88.44 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 179.121 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.558 ' HD2' HG23 ' A' ' 59' ' ' ILE . 9.3 tmtm? -64.49 -23.6 67.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.636 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.692 HD22 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -87.1 -28.37 22.56 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.881 179.223 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.26 -30.97 72.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.317 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.476 ' HG3' HG23 ' A' ' 95' ' ' THR . 13.5 pt-20 -80.15 -18.63 49.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.967 0.413 . . . . 0.0 110.366 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.476 HG23 ' HG3' ' A' ' 94' ' ' GLU . 51.2 p -123.98 25.53 7.9 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.008 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -65.89 127.01 30.12 Favored Glycine 0 N--CA 1.443 -0.871 0 CA-C-N 115.011 -0.995 . . . . 0.0 113.343 -178.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.1 t -141.92 131.83 24.44 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.27 -0.465 . . . . 0.0 111.138 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.02 -127.13 42.33 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.821 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -66.46 -40.02 89.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.596 0.236 . . . . 0.0 111.058 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.53 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -50.67 -41.17 55.25 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.605 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.424 ' CD ' ' HA3' ' A' ' 96' ' ' GLY . 7.9 tpt180 -64.33 -59.11 4.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.092 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -50.02 -23.27 1.95 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.146 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.53 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 13.6 t -66.45 -60.27 2.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.587 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.26 -53.23 60.41 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.169 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.524 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 10.2 p -60.79 -50.07 82.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.52 ' N ' HG13 ' A' ' 105' ' ' VAL . 58.1 t30 -70.75 -30.67 67.25 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.439 ' HD2' ' HG2' ' A' ' 89' ' ' MET . 7.4 t80 -64.56 -49.07 72.67 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -177.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.603 ' HB3' ' HE2' ' A' ' 89' ' ' MET . 3.8 pp -55.03 -12.14 0.8 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.238 -178.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -65.87 -30.27 70.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.917 0.389 . . . . 0.0 110.692 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 22.0 p -112.61 -42.24 3.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.161 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 29.9 p80 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.529 -0.748 . . . . 0.0 111.488 179.74 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.704 ' O ' HD23 ' A' ' 27' ' ' LEU . . . . . . . . 0 N--CA 1.453 -0.318 0 CA-C-O 120.455 0.169 . . . . 0.0 111.392 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.507 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 5.6 t80 -41.96 -55.91 2.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.42 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.41 -58.77 14.11 Favored Pre-proline 0 C--N 1.324 -0.507 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.485 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.553 ' HA ' ' HB2' ' A' ' 29' ' ' GLU . 66.9 Cg_exo -40.51 -36.5 1.78 Allowed 'Trans proline' 0 C--N 1.361 1.217 0 C-N-CA 122.622 2.214 . . . . 0.0 112.462 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.704 HD23 ' O ' ' A' ' 23' ' ' ALA . 3.8 mm? -53.03 -57.06 11.66 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.115 0.483 . . . . 0.0 110.282 178.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.497 HD12 HD12 ' A' ' 31' ' ' LEU . 1.1 tp -74.3 -31.51 62.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.693 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 26' ' ' PRO . 43.2 mt-10 -64.53 -29.77 70.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.584 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.0 t -66.38 -17.35 64.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.226 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.497 HD12 HD12 ' A' ' 28' ' ' LEU . 86.9 mt -67.53 -6.38 19.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 110.741 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.4 p -121.95 21.52 10.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -86.02 149.07 25.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.892 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.65 -31.75 73.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.368 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -82.54 163.3 21.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.734 0.302 . . . . 0.0 110.918 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -110.89 -41.75 4.17 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.476 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -58.9 -29.44 67.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.05 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.14 -42.86 27.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.718 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.465 ' HD2' HG21 ' A' ' 69' ' ' VAL . 33.7 ttm180 -61.99 -20.45 63.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.305 179.457 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.89 -66.26 2.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.282 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.69 -28.27 5.77 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.693 0.282 . . . . 0.0 111.216 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.515 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -62.57 -56.99 12.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.498 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.68 -31.54 72.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.785 179.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -70.87 -34.31 71.49 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.784 -178.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.4 mt -99.24 -21.22 5.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.851 0.358 . . . . 0.0 111.852 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.536 HD13 ' HG2' ' A' ' 57' ' ' PRO . 7.0 tt -61.06 -33.41 55.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -69.51 -22.46 76.53 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.663 -0.78 . . . . 0.0 113.152 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -70.81 -10.95 60.58 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -84.57 -34.82 23.13 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.696 ' HG3' HG12 ' A' ' 80' ' ' ILE . 14.5 mp0 59.74 47.09 10.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.977 0.418 . . . . 0.0 110.952 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.482 ' O ' HG23 ' A' ' 55' ' ' VAL . 10.8 t70 -127.5 178.84 5.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.19 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -60.81 -43.89 97.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.99 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.445 HH11 HD23 ' A' ' 28' ' ' LEU . 15.6 mmt180 -64.47 -10.81 27.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.724 0.297 . . . . 0.0 111.224 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.23 5.47 32.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.642 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 51' ' ' ASP . 94.6 t -90.7 -55.65 6.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.123 -179.132 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.469 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 31.9 tt0 -57.64 -48.87 96.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.177 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.536 ' HG2' HD13 ' A' ' 46' ' ' ILE . 80.2 Cg_exo -42.64 -53.3 3.91 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.379 2.053 . . . . 0.0 112.619 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.547 HD13 HD22 ' A' ' 77' ' ' LEU . 12.3 mt -54.27 -38.77 66.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.71 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 51.0 mm -60.71 -60.2 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -70.1 -7.78 44.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.89 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.764 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.0 OUTLIER -89.49 -42.85 11.23 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.507 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.602 HD13 HD22 ' A' ' 92' ' ' LEU . 8.1 mt -62.13 -9.36 7.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.257 0.551 . . . . 0.0 110.256 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -123.82 -4.79 8.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.635 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.53 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 25.5 t0 -61.06 -29.16 69.57 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.148 0.499 . . . . 0.0 111.107 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.679 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 12.3 t70 55.13 26.24 8.03 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.473 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.509 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 45.9 t -86.28 -3.38 58.97 Favored 'General case' 0 C--N 1.334 -0.104 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.127 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.12 -70.87 2.71 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.867 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.99 -54.53 14.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.216 0.532 . . . . 0.0 109.636 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.764 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.5 t -68.86 -30.31 46.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.272 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.679 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 41.7 ttt180 -71.45 -63.29 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.819 0.342 . . . . 0.0 111.079 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.5 m -61.81 -21.29 64.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.269 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -65.19 -22.17 68.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.341 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.427 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -88.46 -49.85 6.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -44.16 -32.63 1.28 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.727 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' A' ' 75' ' ' ARG . 6.2 ptp180 -79.75 -34.18 40.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 0.0 110.969 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.455 ' HB2' HD22 ' A' ' 58' ' ' LEU . 70.9 m -63.77 -35.99 82.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.453 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.547 HD22 HD13 ' A' ' 58' ' ' LEU . 3.9 mm? -55.46 -59.13 5.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.836 0.35 . . . . 0.0 110.318 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.464 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 34.3 tt0 -63.6 -26.37 68.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.948 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 76' ' ' SER . 21.4 mt-30 -62.32 -51.2 68.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.63 179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.696 HG12 ' HG3' ' A' ' 50' ' ' GLN . 69.0 mt -65.73 -55.59 18.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.681 179.576 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.78 116.67 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.716 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 149.5 177.34 23.5 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.431 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -63.11 -22.41 66.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.815 0.34 . . . . 0.0 110.976 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.534 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -63.09 -58.76 6.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.388 -179.811 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.471 ' H ' ' HG2' ' A' ' 84' ' ' ARG . 4.2 m -70.48 -22.93 24.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.927 0.394 . . . . 0.0 111.288 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -58.71 -35.16 72.21 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.944 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.71 -29.05 67.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.287 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.7 70.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.691 179.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.59 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 17.7 mmm -68.51 -51.72 39.98 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.38 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -54.95 -35.96 64.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.904 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.6 tmtm? -77.73 -25.91 49.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.491 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.602 HD22 HD13 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -86.59 -21.56 26.75 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.156 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.73 -21.13 59.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.725 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -80.35 -24.79 39.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.286 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 81.4 p -122.55 14.82 10.28 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.434 ' C ' ' HB2' ' A' ' 101' ' ' ARG . . . -61.24 128.27 43.88 Favored Glycine 0 N--CA 1.444 -0.782 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.989 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.491 HG23 HH22 ' A' ' 70' ' ' ARG . 4.3 t -139.82 130.16 25.38 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.916 0.389 . . . . 0.0 111.169 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.06 -108.84 2.44 Favored Glycine 0 CA--C 1.519 0.302 0 C-N-CA 121.113 -0.565 . . . . 0.0 113.282 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 103' ' ' VAL . 53.3 t80 -85.6 -40.35 16.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.655 0.264 . . . . 0.0 111.541 -179.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.454 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -48.43 -38.1 18.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 112.059 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.434 ' HB2' ' C ' ' A' ' 96' ' ' GLY . 42.5 ttt180 -73.82 -56.49 4.91 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -46.67 -21.71 0.22 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.179 0.514 . . . . 0.0 110.813 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 99' ' ' PHE . 37.5 t -74.49 -59.69 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.912 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.534 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.37 -44.48 84.44 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.406 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 51.7 t -63.9 -64.07 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -177.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -60.21 -37.57 80.7 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.59 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 24.8 t80 -60.74 -32.42 71.7 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 120.789 0.328 . . . . 0.0 111.074 -178.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 35.6 mt -54.19 -18.24 3.63 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.534 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -71.94 1.62 6.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.099 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 18.9 m -114.24 -80.09 0.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.187 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 61.0 m80 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.948 -179.966 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.512 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.144 0 CA-C-O 120.939 0.399 . . . . 0.0 110.702 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.478 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 11.7 t80 -54.71 -59.98 3.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.342 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.41 -55.56 34.38 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.106 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.512 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 98.5 Cg_exo -42.43 -31.66 1.93 Allowed 'Trans proline' 0 C--N 1.36 1.174 0 C-N-CA 122.298 1.998 . . . . 0.0 111.74 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.481 ' HB2' HH12 ' A' ' 53' ' ' ARG . 33.5 mt -67.91 -58.62 4.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.305 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.595 HD12 HD12 ' A' ' 31' ' ' LEU . 13.7 tp -62.06 -21.92 65.33 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.376 179.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -77.2 -27.47 53.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.634 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.468 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 74.1 m -64.43 -25.81 68.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.977 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.672 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 87.9 mt -65.27 -17.05 64.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.806 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.0 m -102.4 16.37 26.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.107 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.468 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 92.4 m-20 -95.29 143.88 26.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.995 0.426 . . . . 0.0 111.26 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -67.78 -16.51 64.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.903 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -85.33 160.7 19.75 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.66 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 7.3 p90 -109.17 -35.96 6.17 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.455 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.434 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 71.3 ttt180 -60.26 -32.07 70.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.824 0.345 . . . . 0.0 111.224 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 59.3 mt -82.43 -38.39 15.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.501 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.672 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 43.1 ttm180 -64.58 -46.79 81.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.423 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -59.49 -47.89 88.65 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.67 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.93 -27.96 54.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.716 0.293 . . . . 0.0 111.253 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.463 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.33 -56.42 22.36 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.038 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.402 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -65.54 -28.54 69.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.948 0.404 . . . . 0.0 110.801 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.3 m95 -55.4 -42.87 74.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.228 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.8 mt -99.08 -20.37 5.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.545 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.508 HD11 ' NH1' ' A' ' 53' ' ' ARG . 0.2 OUTLIER -56.81 -37.33 53.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.58 -179.264 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.01 -20.5 60.26 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.93 -0.653 . . . . 0.0 113.399 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -69.83 -21.12 63.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -82.61 -27.74 31.27 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.626 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.9 OUTLIER 57.66 27.25 13.99 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.94 0.4 . . . . 0.0 111.38 179.828 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -100.96 158.38 16.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.162 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -56.77 -36.75 70.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.477 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.523 ' O ' ' HD2' ' A' ' 53' ' ' ARG . 0.8 OUTLIER -63.73 -27.55 69.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.891 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.498 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -96.11 0.14 50.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.228 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.6 t -90.83 -41.05 13.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.392 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.555 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 19.1 tt0 -60.61 -49.18 91.02 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 50.5 Cg_exo -54.03 -17.35 10.93 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.647 2.231 . . . . 0.0 113.222 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.54 HD22 ' OG ' ' A' ' 76' ' ' SER . 12.9 mt -86.54 -31.79 21.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.844 0.354 . . . . 0.0 110.93 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.6 mm -63.33 -52.62 56.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.984 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -70.17 -44.55 68.54 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' ' 69' ' ' VAL . 2.0 tp -57.66 -35.74 70.96 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -177.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.709 HD13 HD22 ' A' ' 92' ' ' LEU . 35.2 mt -59.01 -12.08 4.22 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -113.08 -3.6 13.96 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.42 ' OD1' ' HA ' ' A' ' 61' ' ' LEU . 0.9 OUTLIER -60.98 -33.62 73.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.153 0.501 . . . . 0.0 111.117 179.945 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.532 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 17.9 t70 50.34 26.77 2.4 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.373 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.477 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.6 t -82.37 -17.34 45.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.943 0.401 . . . . 0.0 110.372 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 122.2 -114.45 2.5 Favored Glycine 0 N--CA 1.452 -0.254 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.444 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.434 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -55.06 -27.94 48.53 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.376 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.642 HG12 ' HG ' ' A' ' 61' ' ' LEU . 39.5 t -64.92 -38.94 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.621 178.643 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.532 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 44.1 ttp180 -74.69 -40.15 61.55 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.595 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 55.0 m -64.85 -33.74 76.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.09 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.35 -60.35 8.67 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.444 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.538 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . . . -57.12 -31.53 65.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.872 0.368 . . . . 0.0 111.048 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.97 -59.05 5.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.737 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -67.11 -37.51 84.0 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.098 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.54 ' OG ' HD22 ' A' ' 58' ' ' LEU . 60.7 p -53.29 -40.22 64.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.752 0.31 . . . . 0.0 111.237 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.421 ' HB3' HG13 ' A' ' 85' ' ' VAL . 35.2 mt -67.7 -60.17 2.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.828 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -53.18 -25.8 15.0 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.111 0.481 . . . . 0.0 110.219 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.462 HE21 ' HA ' ' A' ' 76' ' ' SER . 4.7 tt0 -68.23 -41.55 81.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.066 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.626 HG12 ' HG3' ' A' ' 50' ' ' GLN . 89.3 mt -63.13 -55.4 23.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.727 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.42 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 66.24 119.34 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.57 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.77 -179.97 27.92 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.278 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -66.38 -33.96 76.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.72 0.295 . . . . 0.0 110.922 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.512 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -62.97 -38.31 90.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.11 -179.78 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.431 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 19.8 t -64.8 -37.16 79.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.819 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 39.4 ttp180 -59.19 -27.36 65.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.513 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.29 76.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.025 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.65 88.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.929 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.54 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 14.4 mmt -66.77 -49.41 65.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.691 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -56.42 -34.98 67.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.82 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.14 -27.59 48.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.985 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.709 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -86.17 -19.79 29.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.16 0.505 . . . . 0.0 109.745 179.663 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.69 -19.95 60.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.692 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.51 -27.6 37.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.332 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 15.6 p -120.18 18.3 12.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.333 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -53.48 125.92 33.12 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.968 -1.015 . . . . 0.0 113.268 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.4 t -139.79 130.32 25.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.035 0.445 . . . . 0.0 110.845 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.23 -121.29 26.17 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.005 -0.617 . . . . 0.0 113.132 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -75.87 -36.53 59.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.66 0.267 . . . . 0.0 111.685 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.495 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.84 -39.72 59.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.871 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -66.33 -59.98 3.2 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.485 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -45.7 -32.85 2.64 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.869 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.442 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 19.9 t -58.98 -59.92 3.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.656 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.516 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.33 -56.4 22.56 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 88.6 t -59.46 -60.68 2.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -178.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -55.4 -37.42 67.58 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.54 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 43.5 t80 -62.84 -22.77 66.9 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 120.907 0.384 . . . . 0.0 110.958 -178.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.4 mt -58.39 -17.21 18.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.166 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -64.79 -24.08 67.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.662 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.1 p -102.39 -58.01 1.95 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.818 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 44.1 m80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.295 -0.86 . . . . 0.0 110.835 179.891 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.452 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.627 0.251 . . . . 0.0 111.395 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.499 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 1.5 t80 -63.34 -48.64 77.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.108 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.444 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 8.6 mt-10 -62.58 -58.1 18.76 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.949 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 11.8 Cg_endo -56.01 -15.54 14.01 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 121.859 1.706 . . . . 0.0 110.955 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.828 HD21 HG13 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -79.12 -38.81 35.24 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.593 179.293 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.502 HD11 ' HG2' ' A' ' 53' ' ' ARG . 7.4 mt -82.18 -22.17 36.14 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.383 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.13 -31.96 69.41 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.512 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.49 ' OG ' HG22 ' A' ' 38' ' ' ILE . 1.5 t -66.18 -26.52 67.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.638 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.589 ' HA ' ' HD2' ' A' ' 39' ' ' ARG . 76.4 mt -56.35 -17.74 8.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.864 -179.424 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.2 m -90.7 21.73 3.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.612 0.244 . . . . 0.0 111.491 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -114.27 123.37 49.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.988 0.423 . . . . 0.0 111.313 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -67.88 -5.6 17.55 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.375 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -75.89 155.85 34.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 0.0 110.947 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.3 p-90 -89.79 -35.0 15.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.068 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -69.35 -33.24 72.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.901 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.49 HG22 ' OG ' ' A' ' 30' ' ' SER . 40.5 mm -82.11 -55.01 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.876 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.589 ' HD2' ' HA ' ' A' ' 31' ' ' LEU . 8.2 tpt180 -57.25 -40.37 77.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.053 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.27 -58.62 10.04 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.931 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.97 -27.31 0.88 Allowed 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.05 -56.78 9.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.843 0.354 . . . . 0.0 111.196 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.578 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -66.41 -37.22 84.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.953 0.406 . . . . 0.0 111.008 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -55.77 -33.4 64.31 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.723 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.3 mm -98.75 -20.45 5.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.187 0.518 . . . . 0.0 110.849 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.828 HG13 HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -60.74 -41.38 88.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.754 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.75 -16.08 36.75 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.716 -179.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -70.73 -43.34 69.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.474 0.178 . . . . 0.0 111.227 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -92.82 105.7 17.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.78 0.324 . . . . 0.0 110.631 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' ' 80' ' ' ILE . 23.7 mp0 -71.82 74.37 0.86 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.524 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -127.82 155.49 44.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.161 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.409 ' HA ' HG23 ' A' ' 55' ' ' VAL . 9.4 pt-20 -64.92 -29.13 70.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.424 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.502 ' HG2' HD11 ' A' ' 28' ' ' LEU . 33.4 ttm180 -69.26 -10.43 57.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.337 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.611 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -105.97 12.97 29.94 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.882 0.372 . . . . 0.0 111.009 -179.473 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.409 HG23 ' HA ' ' A' ' 52' ' ' GLU . 53.2 t -86.63 -50.11 14.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.009 -0.542 . . . . 0.0 112.182 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 42.1 tt0 -55.08 -48.43 96.11 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 94.5 Cg_exo -45.47 -33.77 9.8 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.426 2.084 . . . . 0.0 112.987 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.428 HD22 ' HB2' ' A' ' 76' ' ' SER . 8.7 mt -75.17 -40.77 59.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.829 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.487 HD11 ' HA ' ' A' ' 88' ' ' ALA . 41.0 mm -54.78 -52.96 37.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.16 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -70.09 -22.33 63.05 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.602 ' HG ' HG12 ' A' ' 69' ' ' VAL . 3.0 mp -89.42 -40.13 12.93 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.526 HD11 HD11 ' A' ' 77' ' ' LEU . 13.3 mt -62.2 -10.88 11.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.349 0.595 . . . . 0.0 110.346 -179.238 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -90.67 -39.86 12.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.98 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.485 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 34.5 m-20 -56.52 -179.8 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.76 -178.181 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -153.33 29.7 0.49 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.762 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.424 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 53.3 m -83.66 -3.41 57.72 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.285 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.49 -98.75 2.41 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.392 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -48.69 -32.72 8.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.235 0.54 . . . . 0.0 110.012 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.602 HG12 ' HG ' ' A' ' 61' ' ' LEU . 60.1 t -72.8 -56.78 8.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.104 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 7.3 tmm_? -65.2 -63.66 1.05 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.339 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 97.3 p -52.05 -22.84 4.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.293 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.16 -43.65 98.33 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.594 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.51 ' O ' HD12 ' A' ' 77' ' ' LEU . . . -75.32 -36.84 61.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.573 0.225 . . . . 0.0 111.377 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.22 -40.47 64.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.526 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.3 ptp180 -84.45 -16.58 42.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.489 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.428 ' HB2' HD22 ' A' ' 58' ' ' LEU . 54.9 m -65.91 -45.05 83.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.792 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.54 ' HA ' HG21 ' A' ' 85' ' ' VAL . 5.0 mp -55.8 -59.4 4.93 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.454 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -53.74 -29.46 39.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.804 -0.18 . . . . 0.0 111.099 179.716 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 67.4 mt-30 -70.6 -31.99 69.18 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 121.018 0.437 . . . . 0.0 110.346 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.529 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 95.2 mt -80.43 -60.71 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.173 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.76 113.38 0.01 OUTLIER Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.978 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.91 164.1 12.0 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.633 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -64.03 -26.37 68.53 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.805 0.336 . . . . 0.0 110.837 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.556 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -65.95 -53.49 38.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.764 179.894 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.556 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 12.3 p -70.8 -24.77 25.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.389 0.614 . . . . 0.0 110.263 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.439 ' O ' ' HG3' ' A' ' 89' ' ' MET . 17.0 ttp180 -55.88 -20.87 17.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.72 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.02 -34.07 64.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.364 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.487 ' HA ' HD11 ' A' ' 59' ' ' ILE . . . -60.0 -48.58 81.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.851 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.542 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.23 -31.75 69.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.375 179.739 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.35 -36.51 83.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.164 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 42.7 mmtm -79.94 -28.11 39.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.121 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.491 HD22 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -82.48 -24.03 34.42 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.78 -12.49 61.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.738 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -95.86 -14.87 22.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.914 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.0 p -135.12 16.99 3.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.598 0.713 . . . . 0.0 109.199 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -61.5 148.19 47.22 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 114.734 -1.121 . . . . 0.0 113.226 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.426 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 4.3 t -151.25 130.35 12.65 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.79 -0.705 . . . . 0.0 111.001 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.03 -130.11 50.53 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.976 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.449 ' O ' HG23 ' A' ' 103' ' ' VAL . 78.0 t80 -60.42 -47.54 85.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.635 0.255 . . . . 0.0 111.389 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.435 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.17 -41.5 49.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.51 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.426 ' HB2' ' N ' ' A' ' 97' ' ' THR . 9.3 tpt180 -61.52 -61.68 2.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.384 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -53.3 -27.69 24.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.119 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 99' ' ' PHE . 13.5 t -63.97 -45.79 95.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.954 -179.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -62.56 -58.95 5.74 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 106' ' ' ASN . 7.3 p -64.43 -52.84 50.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.012 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.515 ' N ' HG13 ' A' ' 105' ' ' VAL . 27.1 t-20 -55.78 -32.49 63.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.646 0.26 . . . . 0.0 111.616 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -60.32 -29.24 68.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.058 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 14.1 mt -51.44 -22.36 2.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.65 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.74 3.69 3.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.268 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 53.7 m -105.37 -60.36 1.63 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.788 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.418 ' HD2' ' HD3' ' A' ' 86' ' ' ARG . 82.9 t60 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.638 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.48 ' O ' ' HB3' ' A' ' 27' ' ' LEU . . . . . . . . 0 N--CA 1.457 -0.115 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.424 ' HA ' HD23 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -59.47 -49.42 77.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.999 0.428 . . . . 0.0 110.805 -179.81 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.418 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 10.8 mt-10 -63.42 -58.92 13.43 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.438 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.463 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 15.0 Cg_endo -56.46 -14.38 12.6 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 121.87 1.714 . . . . 0.0 111.062 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.546 HD11 HG12 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -82.9 -39.0 22.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.535 178.954 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.429 HD12 HD12 ' A' ' 31' ' ' LEU . 8.7 tp -85.86 -21.38 28.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.325 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -75.81 -37.56 58.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.708 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 60.9 p -65.3 -23.99 67.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.27 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.429 HD12 HD12 ' A' ' 28' ' ' LEU . 86.2 mt -59.2 -7.26 1.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.673 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.5 p -89.92 19.62 4.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.21 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.543 ' ND2' ' HB ' ' A' ' 38' ' ' ILE . 5.9 p30 -88.19 147.76 24.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.138 0.494 . . . . 0.0 111.432 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.84 -25.74 65.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.622 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.1 162.32 28.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.968 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -110.12 -26.05 9.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.95 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 37' ' ' ARG . 23.4 ttt180 -58.9 -48.16 82.42 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.742 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.543 ' HB ' ' ND2' ' A' ' 33' ' ' ASN . 29.4 mm -56.44 -49.85 75.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.339 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -52.81 -23.84 7.73 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.598 178.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -60.78 -66.59 2.6 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.484 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.3 -42.33 69.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.778 0.323 . . . . 0.0 111.224 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.447 ' HB1' HD12 ' A' ' 27' ' ' LEU . . . -58.02 -54.9 41.73 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.676 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.82 -34.72 74.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.6 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -68.7 -28.07 66.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.773 -179.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.2 mm -91.41 -21.6 6.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.927 0.394 . . . . 0.0 110.54 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.648 HG23 ' HB1' ' A' ' 54' ' ' ALA . 2.4 mm -55.78 -35.16 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.251 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.91 -28.26 63.19 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.869 -0.681 . . . . 0.0 113.022 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -55.4 -51.44 66.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.9 0.381 . . . . 0.0 110.255 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -83.98 115.58 22.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.741 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.68 25.4 0.78 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.132 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.506 ' O ' HG23 ' A' ' 55' ' ' VAL . 6.2 m-20 -84.0 162.45 20.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.376 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.441 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -61.58 -37.06 82.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.589 -179.551 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.6 ttp180 -64.45 -11.32 32.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.986 0.422 . . . . 0.0 110.367 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.648 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -106.02 -10.99 16.3 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.709 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 51' ' ' ASP . 93.6 t -79.05 -44.51 24.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.654 -179.381 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.563 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -57.69 -51.06 84.51 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.496 -179.564 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.563 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.0 Cg_exo -45.29 -51.67 7.52 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.296 1.997 . . . . 0.0 112.252 179.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.522 HD22 ' HA ' ' A' ' 73' ' ' ALA . 16.7 mt -60.63 -35.57 76.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.484 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 55' ' ' VAL . 42.6 mm -62.78 -59.75 3.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.703 0.287 . . . . 0.0 111.585 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.457 ' H ' ' HG3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -70.07 -4.97 23.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.693 -179.341 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.726 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -89.59 -44.44 10.08 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -179.353 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.689 HD13 HD22 ' A' ' 92' ' ' LEU . 5.1 mt -56.74 -15.81 5.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.887 0.375 . . . . 0.0 111.4 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -110.85 -9.33 14.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.501 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.402 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.7 t70 -61.06 -33.43 73.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.108 0.48 . . . . 0.0 111.212 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.583 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 16.5 t70 54.84 28.98 11.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.688 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.497 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 37.8 t -85.33 -10.94 55.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.636 0.255 . . . . 0.0 111.404 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 96.09 -84.33 0.85 Allowed Glycine 0 C--O 1.228 -0.26 0 C-N-CA 120.712 -0.756 . . . . 0.0 111.97 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.66 -41.52 98.2 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.726 HG12 ' HG ' ' A' ' 61' ' ' LEU . 5.2 t -71.97 -43.46 67.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.133 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.583 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 8.3 ttt180 -69.52 -63.36 1.09 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.703 0.287 . . . . 0.0 111.027 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.9 m -52.49 -23.06 5.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.821 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -66.9 -37.43 92.19 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.147 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.522 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -69.72 -47.47 62.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.649 0.261 . . . . 0.0 111.003 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.23 -26.2 62.58 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.214 0.531 . . . . 0.0 110.002 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.9 ttt180 -82.93 -40.45 20.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.449 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.476 ' HB2' HD22 ' A' ' 58' ' ' LEU . 69.8 m -66.94 -33.24 75.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.676 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.553 HD11 HD11 ' A' ' 62' ' ' LEU . 96.8 mt -65.36 -59.72 3.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.675 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.426 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 36.8 tt0 -51.57 -23.09 3.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.161 0.505 . . . . 0.0 110.032 178.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -68.02 -48.14 66.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.985 179.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 82.2 mt -58.21 -60.22 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.713 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 61.13 107.16 0.01 OUTLIER Glycine 0 C--N 1.332 0.356 0 C-N-CA 121.092 -0.575 . . . . 0.0 113.07 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 155.33 -175.47 33.26 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.621 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -71.34 -26.81 62.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.842 0.353 . . . . 0.0 110.737 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.598 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -68.68 -49.71 56.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 -179.746 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.598 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 11.4 p -70.83 -26.93 28.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.276 0.56 . . . . 0.0 110.798 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.431 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 54.7 ttt180 -58.78 -24.59 62.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.532 -179.157 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.94 -29.0 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.93 0.395 . . . . 0.0 110.701 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.73 -37.68 88.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.71 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.537 ' SD ' HD13 ' A' ' 77' ' ' LEU . 6.7 mmm -66.76 -44.38 81.55 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 12.3 mm-40 -57.42 -38.63 74.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.146 178.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -74.49 -29.49 61.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.547 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.689 HD22 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -87.25 -23.48 24.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.005 0.431 . . . . 0.0 110.296 179.48 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.84 -29.16 69.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.422 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.539 ' HG3' HG23 ' A' ' 95' ' ' THR . 11.2 pt-20 -80.17 -18.13 50.53 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.245 0.545 . . . . 0.0 109.779 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.539 HG23 ' HG3' ' A' ' 94' ' ' GLU . 72.0 p -121.93 21.91 10.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.935 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.432 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -60.64 123.12 31.9 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 114.843 -1.071 . . . . 0.0 113.687 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.3 t -147.76 130.06 15.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.809 0.337 . . . . 0.0 110.786 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.7 -132.77 20.42 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.158 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -77.86 -30.89 51.13 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.658 0.266 . . . . 0.0 111.321 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.539 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -55.27 -37.92 67.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.468 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.432 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 44.5 ttt180 -67.41 -59.02 3.73 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.667 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.2 tppt? -47.33 -21.69 0.33 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.961 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.457 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 18.7 t -75.4 -56.98 7.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.92 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.514 ' O ' ' HG ' ' A' ' 108' ' ' LEU . . . -51.31 -57.6 8.44 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 113.502 0.926 . . . . 0.0 113.502 -178.653 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.8 t -58.35 -63.6 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -176.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -59.03 -35.2 72.91 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.532 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 42.9 t80 -63.29 -25.76 68.46 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-O 120.829 0.347 . . . . 0.0 111.116 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 96.8 mt -56.59 -20.79 22.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.882 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -62.65 -12.35 22.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.977 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.4 p -132.05 20.01 4.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.315 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 65.6 m80 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.065 179.59 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.469 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.72 0.295 . . . . 0.0 111.611 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.548 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 2.7 t80 -63.47 -48.84 76.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.819 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.523 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.3 -50.39 74.82 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -179.207 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.523 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 87.6 Cg_exo -41.93 -24.46 0.3 Allowed 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 122.204 1.936 . . . . 0.0 111.719 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 47.1 mt -76.06 -53.02 8.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.133 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 31' ' ' LEU . 24.6 tp -66.98 -24.16 66.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.889 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -76.27 -42.71 44.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.558 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 52.3 m -66.43 -11.18 50.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.981 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 28' ' ' LEU . 38.7 mt -67.17 -10.11 46.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.102 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.7 t -100.21 14.36 31.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.511 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -68.91 150.08 48.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.83 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -63.09 -39.4 94.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.038 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -76.12 156.75 33.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.797 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 7.5 m0 -99.93 -33.03 10.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.644 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -64.94 -46.72 80.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.864 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.3 mt -60.4 -39.27 80.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.603 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.611 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 39.0 ttm180 -63.78 -20.75 66.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.335 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.08 -57.56 11.61 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.778 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.66 -36.44 4.87 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.456 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -67.21 -50.86 59.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.91 0.386 . . . . 0.0 110.69 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.406 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -64.05 -32.77 74.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.989 179.454 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -70.8 -33.92 71.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.49 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.0 mt -99.21 -19.36 5.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.461 HD13 ' HG2' ' A' ' 57' ' ' PRO . 5.6 tt -59.31 -38.03 72.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -178.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.438 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -76.14 -14.01 82.69 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.512 -0.851 . . . . 0.0 112.505 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -70.69 -15.46 62.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.558 0.218 . . . . 0.0 111.148 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -83.02 -22.77 33.5 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.322 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 59.94 24.97 14.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.216 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -93.45 163.36 13.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.152 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.493 ' O ' HG22 ' A' ' 55' ' ' VAL . 13.4 tp10 -66.08 -35.37 80.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.98 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.8 ttm180 -64.3 -10.03 21.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.317 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.548 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -101.96 18.63 20.18 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.493 HG22 ' O ' ' A' ' 52' ' ' GLU . 20.4 m -91.8 -46.35 14.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.478 ' N ' HG23 ' A' ' 55' ' ' VAL . 4.6 tp10 -59.8 -49.45 91.56 Favored Pre-proline 0 CA--C 1.531 0.216 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.0 Cg_exo -45.16 -53.08 5.7 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.993 1.795 . . . . 0.0 111.895 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.479 HD22 ' HB2' ' A' ' 76' ' ' SER . 7.8 mt -57.61 -36.81 72.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.13 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 74.9 mt -63.47 -59.53 4.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.416 ' HG3' HD13 ' A' ' 61' ' ' LEU . 13.6 pttm -66.28 -37.64 85.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.795 0.331 . . . . 0.0 111.631 -178.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.748 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -54.48 -51.82 63.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.923 -179.456 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.486 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 75.1 mt -58.35 -15.85 12.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.876 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.04 -22.94 15.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.586 179.203 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -61.34 -36.17 79.44 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.089 0.471 . . . . 0.0 111.302 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.539 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 20.3 t70 57.44 28.06 14.87 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.019 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.51 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 8.0 t -73.35 -11.86 60.63 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.747 0.308 . . . . 0.0 111.116 -179.766 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.34 -79.01 0.51 Allowed Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.08 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.96 -39.27 69.47 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.748 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.5 t -71.79 -41.49 70.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.84 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.539 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 6.2 tmm_? -67.73 -58.54 4.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.179 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.0 m -57.75 -35.13 70.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.7 -179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -55.75 -30.29 56.23 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.72 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.28 -52.02 15.47 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -45.98 -47.41 16.66 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -70.13 -30.13 67.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.604 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.479 ' HB2' HD22 ' A' ' 58' ' ' LEU . 50.3 m -65.22 -38.64 91.04 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.429 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.435 ' HG ' HG11 ' A' ' 85' ' ' VAL . 8.2 mp -55.56 -59.36 4.94 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.775 0.321 . . . . 0.0 111.026 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 41.7 mt-10 -55.46 -35.96 66.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.974 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' A' ' 76' ' ' SER . 95.2 mt-30 -61.99 -23.63 66.54 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.234 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.509 HG22 ' HD2' ' A' ' 84' ' ' ARG . 39.8 mt -90.22 -61.72 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.402 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.444 ' N ' ' NH1' ' A' ' 84' ' ' ARG . . . 64.33 125.62 0.01 OUTLIER Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.962 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.458 ' O ' ' NH2' ' A' ' 84' ' ' ARG . . . 141.97 -169.95 25.1 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.611 -0.804 . . . . 0.0 113.149 179.722 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' A' ' 86' ' ' ARG . 34.8 tt0 -72.91 -22.51 60.73 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.449 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.77 ' NE ' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.27 -65.38 0.68 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.187 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.77 ' H ' ' NE ' ' A' ' 84' ' ' ARG . 47.8 t -70.8 -20.52 22.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.08 0.467 . . . . 0.0 109.822 178.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.591 ' HA ' ' HE2' ' A' ' 89' ' ' MET . 2.2 tmm_? -46.25 -36.25 5.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.207 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -86.22 -27.86 24.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.705 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.441 ' HB3' HG13 ' A' ' 85' ' ' VAL . . . -65.19 -49.57 69.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.902 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.591 ' HE2' ' HA ' ' A' ' 86' ' ' ARG . 9.3 ptt? -58.73 -41.56 86.72 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.84 0.352 . . . . 0.0 110.294 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -63.2 -29.97 71.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.026 0.441 . . . . 0.0 109.855 178.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.451 ' O ' ' HD3' ' A' ' 91' ' ' LYS . 10.8 tmtt? -71.06 -42.17 69.77 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.562 179.082 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.625 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -74.8 -24.47 58.65 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.543 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.16 -27.68 64.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.46 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -81.57 -26.58 34.85 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.619 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 74.1 p -109.67 20.91 17.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.352 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -55.41 115.59 5.96 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.027 -0.988 . . . . 0.0 113.441 -178.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.6 m -140.0 129.91 24.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.719 0.295 . . . . 0.0 110.697 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.18 -141.92 46.97 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.812 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -63.83 -25.28 68.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 111.202 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.563 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -55.63 -44.07 76.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.815 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.459 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 34.3 ttp180 -64.07 -53.77 44.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.704 0.288 . . . . 0.0 111.412 -179.69 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.6 tptp -50.28 -22.04 1.62 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.887 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.563 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 4.8 t -73.16 -57.58 6.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.901 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.625 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.32 -52.66 64.44 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 51.1 t -60.7 -45.87 96.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.264 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.52 HD22 ' N ' ' A' ' 106' ' ' ASN . 0.9 OUTLIER -70.75 -39.03 73.53 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.166 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.515 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 41.2 t80 -63.51 -23.92 67.59 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.163 0.506 . . . . 0.0 111.024 -178.461 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.493 ' HG ' ' HE3' ' A' ' 89' ' ' MET . 0.5 OUTLIER -49.98 -30.87 11.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.88 179.516 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.579 ' HG3' HG23 ' A' ' 110' ' ' THR . 12.1 pt-20 -65.12 -8.89 18.79 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.579 HG23 ' HG3' ' A' ' 109' ' ' GLU . 62.9 p -130.44 19.12 5.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.618 0.247 . . . . 0.0 111.42 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.2 m80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.994 179.866 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.914 0.388 . . . . 0.0 111.132 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.494 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -59.38 -50.62 73.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.652 -179.604 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.437 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -57.56 -57.36 25.83 Favored Pre-proline 0 C--N 1.325 -0.5 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.185 -179.935 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.527 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 1.1 Cg_endo -49.95 -26.39 14.12 Favored 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 121.944 1.763 . . . . 0.0 111.099 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.642 HD21 ' HA ' ' A' ' 46' ' ' ILE . 0.4 OUTLIER -73.75 -41.93 61.8 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.104 178.94 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.692 HD12 HD12 ' A' ' 31' ' ' LEU . 7.2 tp -76.84 -17.97 58.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.155 -0.93 . . . . 0.0 109.492 178.478 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -70.65 -32.36 69.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.619 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.431 ' OG ' HG22 ' A' ' 38' ' ' ILE . 23.3 t -65.93 -27.09 67.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.188 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.692 HD12 HD12 ' A' ' 28' ' ' LEU . 69.8 mt -66.52 -9.91 39.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.859 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 43.3 t -93.88 16.89 13.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.1 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -100.58 139.42 36.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.931 0.396 . . . . 0.0 111.144 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.69 -16.95 64.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.328 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -78.9 127.51 32.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.845 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -82.41 -27.39 32.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.132 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -62.96 -48.09 80.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.856 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.431 HG22 ' OG ' ' A' ' 30' ' ' SER . 62.0 mt -73.07 -44.36 56.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.015 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.675 ' HG3' HD23 ' A' ' 31' ' ' LEU . 42.8 ttp180 -59.51 -27.5 66.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.821 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.83 -58.43 14.63 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.499 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.52 -42.72 67.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.673 0.273 . . . . 0.0 111.519 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.428 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.97 -56.16 24.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.856 0.36 . . . . 0.0 111.059 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.424 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -61.19 -31.4 71.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.256 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -69.93 -34.93 74.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.694 -0.684 . . . . 0.0 112.736 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.1 mm -98.93 -19.47 5.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.858 0.361 . . . . 0.0 111.843 -178.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.642 ' HA ' HD21 ' A' ' 27' ' ' LEU . 5.8 tt -57.23 -36.63 52.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.932 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.584 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -76.69 -12.55 84.36 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.457 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -68.77 -21.17 64.37 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -83.85 -36.22 23.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.62 0.248 . . . . 0.0 111.249 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.562 ' HG3' HG12 ' A' ' 80' ' ' ILE . 18.8 mp0 68.38 55.81 0.5 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.123 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.455 ' O ' HG23 ' A' ' 55' ' ' VAL . 7.5 m-20 -127.79 -178.28 4.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.02 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.36 -38.44 91.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.954 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -65.7 -12.08 50.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.052 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.9 7.51 32.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.051 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 51' ' ' ASP . 86.1 t -91.37 -59.28 3.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.412 -178.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.44 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 22.5 tt0 -60.09 -49.4 91.17 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.44 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 83.1 Cg_exo -42.56 -52.78 4.2 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.334 2.023 . . . . 0.0 112.86 -179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.528 HD22 ' HA ' ' A' ' 73' ' ' ALA . 12.0 mt -59.81 -34.76 73.47 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.741 -179.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 55' ' ' VAL . 51.3 mm -63.44 -59.89 3.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.105 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.83 -6.37 37.44 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.347 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.698 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -89.42 -37.13 15.04 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.478 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.534 HD13 HD22 ' A' ' 92' ' ' LEU . 5.9 mt -62.97 -9.64 10.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.492 . . . . 0.0 110.651 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -112.48 -12.61 13.47 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.995 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.438 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.0 t0 -61.03 -30.05 70.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.256 0.55 . . . . 0.0 110.668 179.659 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.442 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 38.5 m-20 48.58 30.62 2.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.698 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.521 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 18.4 t -83.82 -5.66 59.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.717 0.294 . . . . 0.0 111.118 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.12 -80.55 1.2 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.279 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -67.52 -43.8 79.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.123 0.487 . . . . 0.0 109.824 179.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.698 HG12 ' HG ' ' A' ' 61' ' ' LEU . 42.3 t -73.45 -38.53 53.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.576 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.442 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 4.8 tmm_? -72.55 -62.62 1.38 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.09 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.2 t -51.99 -27.76 14.55 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.865 0.364 . . . . 0.0 110.813 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.49 -45.76 95.02 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.097 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.528 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -59.89 -45.26 93.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.945 0.402 . . . . 0.0 110.49 179.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.567 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.84 -24.68 67.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.571 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 ttt85 -83.64 -39.01 20.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.333 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.584 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 51.5 m -66.66 -35.82 81.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.01 -179.168 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.52 HD22 HG13 ' A' ' 85' ' ' VAL . 77.7 mt -55.5 -60.12 3.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.737 0.303 . . . . 0.0 111.226 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -53.98 -29.38 42.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.952 0.406 . . . . 0.0 110.289 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 76' ' ' SER . 52.5 mt-30 -70.41 -38.76 74.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.292 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.562 HG12 ' HG3' ' A' ' 50' ' ' GLN . 67.8 mt -75.89 -61.08 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.149 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.522 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 57.99 110.64 0.01 OUTLIER Glycine 0 C--N 1.332 0.312 0 C-N-CA 121.154 -0.546 . . . . 0.0 113.207 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.95 -171.36 37.0 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.769 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -62.56 -40.35 96.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.844 0.354 . . . . 0.0 110.632 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.404 ' CD ' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -58.48 -43.81 89.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.448 179.81 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.522 HG21 ' N ' ' A' ' 81' ' ' GLY . 2.2 t -70.94 -27.58 30.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.589 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HA ' ' SD ' ' A' ' 89' ' ' MET . 0.0 OUTLIER -55.9 -31.44 62.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.804 -179.697 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.52 -19.62 30.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.818 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.87 -50.94 53.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.572 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.405 ' SD ' ' HA ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -72.17 -28.64 63.35 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.815 0.341 . . . . 0.0 110.883 -179.566 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -69.59 -33.03 72.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.801 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -80.66 -25.4 38.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.088 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.708 HD21 ' O ' ' A' ' 100' ' ' ALA . 3.9 tp -86.71 -31.27 21.1 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.93 -26.48 62.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.713 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -79.97 -29.1 39.52 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 36.3 p -110.59 25.88 11.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.982 178.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.516 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -47.14 108.64 0.31 Allowed Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.62 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.5 p -142.7 130.51 21.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.924 0.393 . . . . 0.0 111.241 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.58 -141.37 47.72 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.084 -0.579 . . . . 0.0 113.349 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.459 ' O ' HG23 ' A' ' 103' ' ' VAL . 28.0 t80 -68.35 -27.26 66.1 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 122.465 0.306 . . . . 0.0 111.68 -179.396 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.708 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -54.52 -47.71 72.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.878 0.37 . . . . 0.0 111.738 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.516 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 45.9 ttp180 -56.41 -59.97 4.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.802 -179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -45.57 -25.76 0.5 Allowed 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.953 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.585 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 52.6 t -74.68 -56.51 8.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.608 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.534 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -53.84 -47.25 71.14 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.556 ' HA ' HD12 ' A' ' 108' ' ' LEU . 48.8 t -65.48 -55.52 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.512 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -62.72 -43.74 98.03 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.416 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 31.0 t80 -60.51 -27.56 67.7 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 120.889 0.376 . . . . 0.0 111.527 -178.374 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.556 HD12 ' HA ' ' A' ' 105' ' ' VAL . 9.9 mt -56.58 -21.51 27.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.537 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -77.06 4.43 10.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.582 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 5.2 m -111.38 -75.76 0.61 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.749 0.309 . . . . 0.0 111.051 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.819 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.501 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.579 0.228 . . . . 0.0 111.39 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.565 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.2 t80 -63.34 -46.91 84.43 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.841 0.353 . . . . 0.0 110.316 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' A' ' 27' ' ' LEU . 37.1 mt-10 -43.34 -54.24 10.04 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.501 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 53.7 Cg_exo -35.99 -31.05 0.08 OUTLIER 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.515 2.143 . . . . 0.0 112.011 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.495 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 75.2 mt -71.71 -57.55 4.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.132 178.316 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.561 HD22 HD12 ' A' ' 31' ' ' LEU . 3.4 tm? -55.5 -39.66 70.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.726 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -62.75 -29.37 70.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.336 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 29.1 t -64.53 -20.42 66.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.428 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.617 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 59.5 mt -69.63 -11.74 61.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.805 0.336 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.2 m -101.99 14.61 31.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.004 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -94.05 139.51 30.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.883 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.421 ' CD ' ' H ' ' A' ' 34' ' ' GLU . 2.9 mp0 -63.22 -17.9 62.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.8 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -77.2 155.68 32.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.139 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -110.83 -39.31 4.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.667 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -60.03 -34.24 73.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.976 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.1 mt -82.61 -42.98 18.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.265 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.617 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 40.6 ttm180 -58.66 -47.54 84.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.395 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.03 -56.23 26.3 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.687 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.36 -33.76 21.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.772 0.32 . . . . 0.0 111.224 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.81 -47.48 84.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.599 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -76.6 -23.69 53.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.156 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.2 m95 -61.13 -38.39 86.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.011 0.434 . . . . 0.0 110.588 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.0 mm -99.86 -18.71 6.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.267 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.599 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -50.09 -44.61 22.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.17 -178.882 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.419 ' N ' ' CG2' ' A' ' 46' ' ' ILE . . . -72.53 -14.68 77.48 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.617 -0.801 . . . . 0.0 113.04 -179.301 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -70.69 -10.6 59.78 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.552 0.205 . . . . 0.0 111.552 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -92.75 -26.05 17.92 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.636 ' HG3' HG12 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 62.51 51.03 3.38 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.942 0.401 . . . . 0.0 111.123 -179.849 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -127.17 171.28 11.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.99 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.75 -36.56 83.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.794 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -66.61 -9.61 37.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.771 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.565 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -100.99 3.86 41.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.648 -179.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 47.6 t -92.06 -53.23 9.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.246 -179.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.558 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 12.7 tt0 -60.15 -51.21 81.98 Favored Pre-proline 0 CA--C 1.533 0.289 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -178.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 82.8 Cg_exo -46.58 -37.31 20.08 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.332 2.021 . . . . 0.0 112.649 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.466 ' HB3' HD11 ' A' ' 77' ' ' LEU . 48.9 mt -65.77 -40.55 92.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.065 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.459 HD11 ' HA ' ' A' ' 88' ' ' ALA . 46.7 mm -52.77 -54.38 16.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.294 -0.412 . . . . 0.0 112.08 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.82 74.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.042 -178.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.786 HD23 ' H ' ' A' ' 73' ' ' ALA . 0.3 OUTLIER -64.52 -37.54 87.91 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.284 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.507 ' HB3' HD22 ' A' ' 92' ' ' LEU . 34.9 mt -59.72 -13.73 11.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.306 0.574 . . . . 0.0 110.104 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -112.51 -13.43 13.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.241 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.477 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.6 OUTLIER -61.25 93.99 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.759 179.639 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -75.04 33.95 0.1 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.083 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.474 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 10.8 t -79.36 -27.11 41.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.972 0.415 . . . . 0.0 110.404 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.74 -110.12 1.13 Allowed Glycine 0 N--CA 1.453 -0.186 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.097 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -54.68 -25.46 27.31 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.596 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.3 t -64.72 -47.28 89.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.047 178.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.408 ' NH1' ' HB3' ' A' ' 99' ' ' PHE . 1.6 ttm180 -54.58 -54.44 41.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.948 0.404 . . . . 0.0 110.423 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 80.7 p -67.24 -16.59 64.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.071 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.565 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -52.53 -67.55 2.02 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.519 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.786 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -59.24 -36.51 75.6 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.538 0.209 . . . . 0.0 111.173 179.244 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -45.35 -56.38 5.01 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.574 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 72' ' ' GLY . 0.0 OUTLIER -70.2 -26.73 64.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.144 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.629 ' HA ' HE21 ' A' ' 79' ' ' GLN . 51.8 m -64.77 -39.27 93.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.74 0.305 . . . . 0.0 111.032 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.466 HD11 ' HB3' ' A' ' 58' ' ' LEU . 4.8 mp -61.08 -60.45 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.873 0.368 . . . . 0.0 110.55 179.13 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -57.21 -19.93 23.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.636 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.629 HE21 ' HA ' ' A' ' 76' ' ' SER . 3.3 tt0 -68.08 -56.99 6.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.432 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.656 ' HB ' HG21 ' A' ' 85' ' ' VAL . 82.7 mt -64.99 -60.59 2.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.143 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.12 102.37 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.451 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 174.83 -174.6 46.76 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.673 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -68.5 -37.03 79.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.872 0.368 . . . . 0.0 110.88 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.49 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.91 -46.19 90.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.528 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.656 HG21 ' HB ' ' A' ' 80' ' ' ILE . 21.3 t -70.88 -25.14 25.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.147 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -58.42 -35.01 71.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.55 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.33 -21.85 48.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.386 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.459 ' HA ' HD11 ' A' ' 59' ' ' ILE . . . -71.4 -41.86 69.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.287 179.545 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.672 ' HE1' HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -72.26 -35.0 68.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.136 179.6 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -60.43 -44.88 95.33 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.513 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' A' ' 91' ' ' LYS . 3.8 tmtp? -62.34 -32.53 73.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.838 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.698 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.6 OUTLIER -83.06 -25.48 32.04 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.73 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.01 -18.92 64.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.332 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -80.3 -31.04 38.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.873 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.4 p -115.83 22.13 13.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.56 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.431 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.27 119.09 11.78 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.255 -0.884 . . . . 0.0 113.339 -178.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 26.0 m -143.83 129.11 18.83 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.744 0.306 . . . . 0.0 110.804 178.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.24 -136.34 51.05 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.861 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.495 ' O ' HG23 ' A' ' 103' ' ' VAL . 64.3 t80 -60.86 -38.01 84.1 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.797 0.332 . . . . 0.0 110.711 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.553 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.71 -41.59 56.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.879 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.431 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 38.6 ttt180 -68.91 -59.54 2.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.793 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -46.29 -23.97 0.42 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.917 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 99' ' ' PHE . 24.9 t -66.16 -60.31 2.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.276 179.488 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.698 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.48 -52.0 67.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.968 0.413 . . . . 0.0 111.774 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 61.7 t -57.69 -61.72 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.496 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -58.62 -30.06 66.98 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -59.71 -27.05 66.12 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.017 0.437 . . . . 0.0 110.49 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.672 HD11 ' HE1' ' A' ' 89' ' ' MET . 18.2 mt -59.99 -29.3 68.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.448 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -52.45 -25.75 10.91 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.152 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.8 p -101.91 -50.67 3.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.037 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.896 -179.817 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.508 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 121.089 0.471 . . . . 0.0 110.164 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.524 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 3.0 t80 -63.35 -46.45 86.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.925 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.436 ' O ' ' N ' ' A' ' 27' ' ' LEU . 6.4 mm-40 -63.4 -51.95 64.1 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.675 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.508 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 95.8 Cg_exo -42.93 -19.12 0.12 Allowed 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 122.427 2.085 . . . . 0.0 111.926 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.521 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.2 mt -85.66 -52.39 5.83 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.159 178.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.598 HD12 HD12 ' A' ' 31' ' ' LEU . 52.5 tp -59.29 -33.65 71.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.728 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 26' ' ' PRO . 8.6 pt-20 -61.99 -28.42 69.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.843 0.354 . . . . 0.0 110.745 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.402 ' HB3' ' HB2' ' A' ' 42' ' ' ALA . 32.8 t -63.69 -21.39 66.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.516 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.643 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 42.0 mt -67.5 -6.74 21.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.696 0.284 . . . . 0.0 111.047 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 91.5 p -113.94 20.45 15.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.318 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.04 150.42 21.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.87 0.367 . . . . 0.0 111.184 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.95 -29.18 69.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.048 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -78.29 160.69 27.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.926 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.9 p90 -111.15 -39.6 4.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.177 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -59.68 -34.65 73.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.933 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.7 mt -76.86 -42.52 33.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.683 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.643 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 27.5 ttm180 -54.16 -32.18 54.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.71 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.4 -47.07 65.19 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.232 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.3 -24.81 12.63 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.759 0.314 . . . . 0.0 111.138 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.414 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -68.58 -57.42 5.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.388 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.82 -17.5 62.15 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.24 0.543 . . . . 0.0 110.582 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -46.79 87.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.183 -179.203 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 12.6 mt -98.53 -24.32 4.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.414 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 5.1 tt -56.44 -24.59 19.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.685 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 76' ' ' SER . . . -74.44 -27.43 65.63 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.905 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -59.84 -22.31 62.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.646 0.26 . . . . 0.0 111.471 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -105.07 107.73 18.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.425 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.754 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.4 mp0 -65.91 78.87 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.139 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -127.61 153.86 45.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.514 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.613 ' O ' HG22 ' A' ' 55' ' ' VAL . 13.5 pt-20 -64.91 -28.44 69.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.443 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -69.33 -12.12 61.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.363 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.524 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -104.37 21.94 15.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 52' ' ' GLU . 32.7 m -91.75 -57.88 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.717 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.581 ' N ' HG23 ' A' ' 55' ' ' VAL . 28.7 tt0 -60.31 -50.52 85.47 Favored Pre-proline 0 CA--C 1.533 0.319 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.549 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.5 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 95.1 Cg_exo -40.37 -52.03 3.15 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.495 2.13 . . . . 0.0 112.99 -179.539 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.451 HD22 ' OG ' ' A' ' 76' ' ' SER . 4.1 mt -62.97 -46.67 86.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.717 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 55' ' ' VAL . 47.6 mm -56.82 -56.24 15.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -70.09 -16.99 63.2 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.734 ' HG ' HG13 ' A' ' 69' ' ' VAL . 11.4 tp -90.47 -40.7 11.86 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -177.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.498 ' HA ' ' HA ' ' A' ' 70' ' ' ARG . 2.9 pp -64.6 -9.76 21.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.76 0.314 . . . . 0.0 111.657 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.479 ' HG3' HD12 ' A' ' 62' ' ' LEU . 24.0 mt-10 -98.81 -11.87 21.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.553 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.421 ' HB3' ' CG1' ' A' ' 69' ' ' VAL . 7.0 t70 -62.58 -30.64 71.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.175 0.512 . . . . 0.0 111.339 -179.077 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.683 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 12.3 m-20 63.6 23.94 13.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.935 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.418 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 25.8 t -83.68 1.37 42.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.603 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.625 ' H ' ' HG2' ' A' ' 70' ' ' ARG . . . 84.8 -94.17 1.86 Allowed Glycine 0 C--O 1.227 -0.311 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.671 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -49.33 -44.88 44.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.41 0.624 . . . . 0.0 110.066 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.734 HG13 ' HG ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -63.4 -44.76 99.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.076 -0.966 . . . . 0.0 112.271 -178.976 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.683 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 13.6 ptt180 -78.44 -22.48 47.56 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 67.6 m -66.85 -52.11 47.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.588 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -52.73 -47.73 57.9 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.013 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.43 ' HB1' ' O ' ' A' ' 58' ' ' LEU . . . -56.56 -39.27 73.17 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.019 0.438 . . . . 0.0 110.882 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.87 -54.2 45.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.782 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 71' ' ' SER . 6.6 ptp180 -70.99 -27.26 63.57 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.451 ' OG ' HD22 ' A' ' 58' ' ' LEU . 32.0 p -63.33 -40.04 96.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.454 0.169 . . . . 0.0 111.449 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 93.1 mt -61.43 -59.83 4.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.719 0.295 . . . . 0.0 110.572 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.402 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 38.4 tt0 -55.16 -25.73 34.1 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.095 0.474 . . . . 0.0 110.052 178.711 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -69.46 -45.0 70.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.223 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.754 HG23 ' HG3' ' A' ' 50' ' ' GLN . 90.4 mt -64.16 -61.13 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.712 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.46 124.53 0.01 OUTLIER Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.008 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 150.65 165.17 12.48 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.914 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -58.13 -22.27 50.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.863 0.363 . . . . 0.0 110.76 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.692 ' HD3' HG23 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -74.06 -36.67 64.37 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.895 -179.693 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.692 HG23 ' HD3' ' A' ' 84' ' ' ARG . 13.7 t -70.77 -28.59 34.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.013 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 86' ' ' ARG . 18.1 tpt85 -51.39 -29.52 15.96 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.215 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.12 -31.21 23.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.098 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.47 -56.66 12.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.592 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.515 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 3.2 ppp? -64.21 -24.87 67.83 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.563 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.433 ' N ' ' SD ' ' A' ' 89' ' ' MET . 6.0 mm-40 -68.8 -31.22 70.07 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.437 ' O ' ' HD3' ' A' ' 91' ' ' LYS . 1.8 tmtp? -71.53 -37.24 71.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.358 179.24 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.589 HD21 ' O ' ' A' ' 100' ' ' ALA . 0.1 OUTLIER -82.2 -26.87 32.97 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.63 -26.32 66.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.192 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -80.17 -26.81 39.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.719 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.8 p -109.96 19.24 19.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.576 178.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.521 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -52.93 111.71 1.82 Allowed Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.276 -0.874 . . . . 0.0 113.101 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.2 t -142.85 130.85 21.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.838 0.352 . . . . 0.0 110.873 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.44 -126.6 35.89 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.729 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -80.58 -29.84 36.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.882 0.372 . . . . 0.0 110.855 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.589 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.57 -34.7 38.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.677 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.521 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 42.4 ttt180 -72.04 -56.68 5.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.738 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -45.95 -23.15 0.26 Allowed 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.769 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 53.9 t -69.92 -57.66 7.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.593 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.515 ' HB1' ' HB2' ' A' ' 89' ' ' MET . . . -59.47 -55.27 36.75 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.519 HG13 ' N ' ' A' ' 106' ' ' ASN . 7.0 p -62.64 -55.72 22.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.682 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.519 ' N ' HG13 ' A' ' 105' ' ' VAL . 27.1 t-20 -56.95 -31.23 64.77 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -178.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.416 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 7.0 t80 -60.4 -33.4 72.43 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.103 0.478 . . . . 0.0 110.635 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -54.38 -13.3 0.87 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.788 -179.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -54.2 -20.68 7.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.202 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.6 p -110.82 -69.64 0.86 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.351 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 60.9 m80 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.92 -179.929 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.469 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 120.832 0.349 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.427 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 3.8 t80 -61.62 -42.15 98.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.016 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -59.4 -54.55 54.94 Favored Pre-proline 0 C--N 1.33 -0.279 0 C-N-CA 120.629 -0.429 . . . . 0.0 111.384 -179.585 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 52.2 Cg_exo -48.28 -26.39 8.28 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.886 1.724 . . . . 0.0 110.86 178.714 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.538 HD21 HG13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -80.14 -36.41 35.26 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.618 179.472 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.717 HD12 HD12 ' A' ' 31' ' ' LEU . 9.4 tp -76.99 -24.61 52.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.446 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -68.94 -42.66 76.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.897 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.6 m -66.56 -12.87 59.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.569 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.717 HD12 HD12 ' A' ' 28' ' ' LEU . 81.1 mt -68.9 -7.16 32.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.687 0.28 . . . . 0.0 111.252 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.2 p -110.16 8.04 23.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.035 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.606 ' ND2' ' HB ' ' A' ' 38' ' ' ILE . 20.2 p-10 -67.58 150.32 48.95 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.923 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -64.12 -31.16 72.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.325 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.27 152.27 36.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.075 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 13.4 p90 -100.61 -33.33 10.35 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.161 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -58.79 -50.91 72.18 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.428 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.606 ' HB ' ' ND2' ' A' ' 33' ' ' ASN . 77.8 mt -63.22 -39.76 86.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.368 179.405 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.535 ' CZ ' HG11 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -62.3 -23.47 66.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.158 179.504 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.09 -59.61 4.57 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.032 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.6 -36.17 4.54 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.829 0.347 . . . . 0.0 110.78 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.409 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.53 -48.97 79.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.261 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.428 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -66.19 -30.64 71.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.042 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.0 m95 -68.31 -32.44 72.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.506 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.5 mt -98.93 -19.88 5.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.784 0.326 . . . . 0.0 111.528 -179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.538 HG13 HD21 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -60.35 -40.25 83.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.866 -178.908 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.07 -23.35 78.11 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.639 -0.791 . . . . 0.0 113.078 -179.473 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -70.75 2.08 4.62 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -101.22 -28.15 12.82 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.539 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.458 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.3 OUTLIER 57.26 31.48 20.17 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.117 0.484 . . . . 0.0 110.897 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -102.55 162.69 12.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.137 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -61.76 -33.49 74.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 110.574 179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.502 ' NE ' HD22 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -68.24 -16.68 64.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.354 179.721 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -96.75 -5.83 37.66 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.664 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.15 -46.29 34.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.535 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.531 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 34.6 tt0 -60.37 -50.4 85.97 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 95.0 Cg_exo -44.15 -53.85 4.38 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.549 2.166 . . . . 0.0 113.016 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.656 HD13 HD22 ' A' ' 77' ' ' LEU . 9.6 mt -54.5 -37.64 65.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.442 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.1 mm -59.67 -61.04 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -70.62 -12.21 61.42 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.06 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.782 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -89.39 -41.53 12.06 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -177.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.79 HD13 HD22 ' A' ' 92' ' ' LEU . 12.3 mt -64.49 -9.89 21.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.115 0.483 . . . . 0.0 110.997 -178.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -116.18 -12.11 11.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.703 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.471 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -61.27 -32.91 72.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.346 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.563 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 17.8 m-20 59.13 29.35 18.89 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.301 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.484 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 11.8 m -79.81 10.09 4.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.728 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 67.84 -82.29 0.17 Allowed Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.427 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -48.79 78.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.021 0.438 . . . . 0.0 110.156 179.459 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.782 HG12 ' HG ' ' A' ' 61' ' ' LEU . 2.1 t -72.67 -44.26 60.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.675 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.563 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 3.7 tmm_? -59.03 -48.34 81.96 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.849 0.357 . . . . 0.0 110.444 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.415 ' HB3' HH12 ' A' ' 75' ' ' ARG . 72.7 m -67.1 -36.77 82.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.787 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.05 -30.0 60.07 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.676 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.423 ' O ' HD23 ' A' ' 77' ' ' LEU . . . -80.73 -40.23 25.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.646 0.26 . . . . 0.0 110.846 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.514 ' HA ' HG11 ' A' ' 103' ' ' VAL . . . -49.83 -45.36 50.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.732 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.415 HH12 ' HB3' ' A' ' 71' ' ' SER . 3.7 ptp85 -72.24 -25.61 61.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.579 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.409 ' HB2' HD22 ' A' ' 58' ' ' LEU . 41.9 m -67.19 -35.54 79.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.763 -179.397 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.77 HD21 HD11 ' A' ' 62' ' ' LEU . 4.0 mm? -55.55 -59.95 4.11 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.837 0.351 . . . . 0.0 110.724 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -64.18 -25.76 68.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.968 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -61.54 -43.98 97.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.212 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.458 HG12 ' HG3' ' A' ' 50' ' ' GLN . 64.8 mt -70.22 -60.86 2.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.271 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.417 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 66.59 108.37 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.788 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.504 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 152.29 -176.26 30.62 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.653 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -71.55 -31.85 67.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.339 . . . . 0.0 110.971 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.567 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.09 -54.03 49.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.567 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 9.3 p -70.65 -24.42 25.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.135 0.493 . . . . 0.0 110.816 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -57.31 -26.82 61.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.118 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.27 -26.93 47.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.987 0.422 . . . . 0.0 110.674 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.25 -46.56 60.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.305 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.495 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.92 -33.66 70.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.867 0.365 . . . . 0.0 110.566 179.837 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.4 -41.34 98.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.428 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -70.72 -24.49 62.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.025 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.79 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -84.86 -30.08 24.76 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.08 67.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.619 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.33 -25.78 39.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.343 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.3 p -117.1 21.39 13.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.33 179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -55.52 119.77 15.31 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 114.946 -1.024 . . . . 0.0 113.46 -178.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 29.8 m -139.76 129.87 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.556 -0.322 . . . . 0.0 110.361 179.004 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.73 -143.47 48.65 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.757 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -63.9 -30.34 71.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.756 0.312 . . . . 0.0 111.527 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.599 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -54.15 -34.38 60.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.117 -179.163 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.411 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 60.3 ttt180 -70.86 -58.95 3.09 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 20.9 ttmm -45.84 -25.45 0.52 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.171 0.51 . . . . 0.0 111.082 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.514 HG11 ' HA ' ' A' ' 74' ' ' ALA . 37.7 t -67.41 -48.29 77.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.375 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.619 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -64.85 -59.31 4.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.567 0.699 . . . . 0.0 112.251 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.463 HG22 ' H ' ' A' ' 105' ' ' VAL . 0.0 OUTLIER -59.39 -63.01 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 114.731 -1.122 . . . . 0.0 113.973 -177.955 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.449 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 10.0 m120 -55.53 -25.59 38.37 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.417 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 2.1 t80 -59.0 -35.85 73.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.039 0.447 . . . . 0.0 109.927 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 46.3 mt -52.57 -22.53 5.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.717 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -64.25 -6.29 6.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.541 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.2 m -117.12 -47.6 2.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.742 0.306 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 76.8 m80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.93 179.701 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.457 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.175 0 CA-C-O 120.693 0.283 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.415 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.7 t80 -61.87 -48.76 79.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.595 179.582 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.4 -55.29 36.76 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.735 179.644 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 40.4 Cg_exo -50.56 -21.33 7.54 Favored 'Trans proline' 0 C--N 1.359 1.106 0 C-N-CA 121.838 1.692 . . . . 0.0 110.432 179.058 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.63 HD21 HG13 ' A' ' 46' ' ' ILE . 1.3 tp -86.32 -38.11 17.82 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.138 -1.392 . . . . 0.0 109.966 179.768 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.696 HD12 HD12 ' A' ' 31' ' ' LEU . 15.1 tp -74.58 -21.89 59.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.41 179.208 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.53 -35.23 75.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.878 -179.717 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.0 m -63.71 -24.48 67.79 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.514 -179.665 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.696 HD12 HD12 ' A' ' 28' ' ' LEU . 90.1 mt -67.46 -16.59 64.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.12 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.4 m -100.27 12.16 37.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.793 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -85.36 144.19 28.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.057 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -67.53 -29.42 68.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.035 -179.921 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -75.93 144.92 40.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.055 -179.831 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.516 ' HB2' HG21 ' A' ' 69' ' ' VAL . 58.1 p-90 -89.39 -31.93 17.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.748 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.413 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 4.9 tmt_? -58.96 -35.43 73.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.654 179.616 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 mm -82.74 -47.02 18.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.542 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.514 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 51.3 ttp180 -57.43 -42.07 81.67 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.772 -179.273 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -55.95 -63.08 5.62 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.739 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.7 -25.98 0.84 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.65 0.262 . . . . 0.0 111.596 -179.821 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 39' ' ' ARG . . . -64.11 -57.0 10.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.794 0.33 . . . . 0.0 110.397 179.529 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.95 -24.95 68.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.499 179.475 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.422 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 8.1 m95 -61.2 -44.91 96.54 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.154 -179.489 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.8 mm -98.78 -19.05 6.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -178.886 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.63 HG13 HD21 ' A' ' 27' ' ' LEU . 5.8 tt -56.43 -34.25 40.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -178.499 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.42 -19.02 79.73 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.567 -0.825 . . . . 0.0 113.184 -179.277 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -70.87 2.39 4.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.376 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -107.06 -18.43 13.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -179.545 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.677 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 55.97 56.54 5.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.807 0.336 . . . . 0.0 111.249 -179.679 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -127.61 161.16 29.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.023 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.433 ' HA ' HG23 ' A' ' 55' ' ' VAL . 13.1 pt-20 -65.86 -30.6 71.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.692 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.54 ' HD3' HD22 ' A' ' 28' ' ' LEU . 17.2 ttm180 -69.17 -10.89 59.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.69 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.415 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -106.3 3.17 27.34 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.066 -179.557 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.569 HG22 HH12 ' A' ' 84' ' ' ARG . 64.5 t -83.2 -55.09 7.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.173 -178.994 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.487 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 18.9 tt0 -59.17 -49.01 95.26 Favored Pre-proline 0 CA--C 1.532 0.271 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.69 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.487 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 90.4 Cg_exo -42.94 -32.33 2.63 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.484 2.123 . . . . 0.0 112.732 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.685 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 4.8 mt -73.35 -52.71 12.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.736 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 38.5 mm -49.25 -50.75 15.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.968 -179.503 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.99 -32.85 71.26 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -178.629 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.535 ' HG ' HG12 ' A' ' 69' ' ' VAL . 5.2 tp -89.82 -12.41 39.21 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.895 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.594 HD13 HD22 ' A' ' 92' ' ' LEU . 17.0 mt -72.97 -13.84 61.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.881 0.372 . . . . 0.0 111.1 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -116.03 9.78 14.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.101 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.07 -31.75 71.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.265 0.555 . . . . 0.0 110.931 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 23.3 m-20 51.9 25.14 2.88 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.237 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.9 t -86.22 -17.15 35.54 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.758 0.314 . . . . 0.0 110.825 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.76 -110.22 1.6 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.311 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.422 ' HD1' ' NE1' ' A' ' 44' ' ' TRP . 0.1 OUTLIER -60.33 -26.58 66.68 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.469 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.535 HG12 ' HG ' ' A' ' 61' ' ' LEU . 24.3 t -69.46 -30.04 44.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.628 178.685 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.463 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 57.5 ttp180 -78.38 -55.74 5.0 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.464 179.391 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.469 ' O ' ' HG3' ' A' ' 75' ' ' ARG . 46.2 m -62.37 -28.0 69.47 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.967 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.5 -59.98 9.79 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.583 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.685 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -60.68 -27.94 68.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.786 0.327 . . . . 0.0 110.911 179.984 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.549 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.9 -45.15 95.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.573 -179.775 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.519 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 28.5 mtp85 -62.2 -33.47 74.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.412 -179.578 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.8 m -50.74 -46.48 59.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.846 -178.358 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.612 ' H ' HD12 ' A' ' 77' ' ' LEU . 5.7 mp -56.96 -55.76 30.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.844 0.354 . . . . 0.0 110.133 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -59.1 -32.76 70.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.281 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 29.6 mt-30 -65.32 -30.74 71.62 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.803 0.335 . . . . 0.0 110.776 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.677 HG23 ' HG3' ' A' ' 50' ' ' GLN . 90.1 mt -90.06 -60.88 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.3 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.51 113.66 0.01 OUTLIER Glycine 0 C--N 1.331 0.27 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.016 179.754 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.03 174.89 30.39 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.629 179.851 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.3 -32.77 74.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.809 0.338 . . . . 0.0 111.004 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.698 HH11 HG13 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -61.48 -54.85 37.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.469 179.948 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.698 HG13 HH11 ' A' ' 84' ' ' ARG . 0.0 OUTLIER -70.72 -21.62 22.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.834 179.213 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -56.44 -27.79 57.68 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.712 179.921 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.62 -27.55 45.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.241 179.69 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.69 -47.08 79.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.666 179.497 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.499 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 3.0 ppp? -67.57 -25.91 66.02 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.76 0.314 . . . . 0.0 110.215 179.735 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.442 ' N ' ' SD ' ' A' ' 89' ' ' MET . 37.0 mt-10 -69.03 -39.27 79.32 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.707 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -69.46 -31.2 69.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.908 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.594 HD22 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -85.73 -24.29 26.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.096 -179.945 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.99 -28.76 70.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.68 179.391 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -80.34 -25.01 39.46 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.048 0.451 . . . . 0.0 110.011 179.627 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.0 p -111.99 17.48 19.63 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.393 179.215 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.436 ' HA3' ' CD ' ' A' ' 101' ' ' ARG . . . -55.76 121.5 23.4 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.887 -179.346 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.6 t -139.81 130.11 25.32 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.432 -0.384 . . . . 0.0 111.267 179.455 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 51.58 -113.23 2.24 Favored Glycine 0 C--N 1.33 0.215 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.743 179.893 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.473 ' O ' HG23 ' A' ' 103' ' ' VAL . 70.7 t80 -78.71 -33.32 46.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.756 0.312 . . . . 0.0 110.91 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.482 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.57 -39.46 64.83 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.61 -179.929 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.436 ' CD ' ' HA3' ' A' ' 96' ' ' GLY . 8.5 tpt180 -66.66 -61.28 2.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.677 0.275 . . . . 0.0 111.341 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -48.26 -26.78 2.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.884 -179.664 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.482 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 8.5 t -61.13 -52.7 58.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.022 179.53 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.499 ' HB1' ' HB2' ' A' ' 89' ' ' MET . . . -64.84 -59.81 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.124 -179.475 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 52.1 t -52.58 -63.03 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.934 -178.675 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -56.03 -33.94 65.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -178.844 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -61.08 -25.57 67.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.028 0.442 . . . . 0.0 111.067 -179.398 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.448 HD11 ' HE1' ' A' ' 89' ' ' MET . 81.1 mt -57.89 -21.53 43.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.735 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -96.29 7.04 47.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.77 -179.16 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 66.8 p -119.97 -16.46 8.63 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -179.125 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.066 -0.969 . . . . 0.0 110.81 -179.746 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.407 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.622 0.248 . . . . 0.0 111.582 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.589 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.2 t80 -63.26 -44.64 94.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.038 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.35 -56.17 29.49 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.834 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.407 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 89.5 Cg_exo -45.15 -26.85 2.5 Favored 'Trans proline' 0 C--N 1.358 1.052 0 C-N-CA 122.022 1.815 . . . . 0.0 111.269 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.3 mt -71.21 -55.92 7.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.142 -0.936 . . . . 0.0 109.51 178.3 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.569 HD12 HD12 ' A' ' 31' ' ' LEU . 14.8 tp -63.64 -18.49 64.0 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.95 178.814 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -82.91 -30.17 28.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.66 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.474 ' OG ' HG22 ' A' ' 38' ' ' ILE . 44.2 t -65.09 -17.16 64.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.995 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.657 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 89.1 mt -66.28 -20.88 66.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.941 179.978 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.2 m -89.78 19.17 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.605 179.502 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -101.48 131.6 47.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.053 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -66.87 -11.32 55.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.469 -179.658 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -86.38 133.42 33.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.903 0.383 . . . . 0.0 111.329 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 53.8 p-90 -79.03 -32.1 44.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.366 179.423 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -64.97 -50.43 66.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.14 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.474 HG22 ' OG ' ' A' ' 30' ' ' SER . 71.5 mt -66.94 -51.7 51.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.228 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.657 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 32.1 ttm180 -58.59 -24.62 61.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.815 0.341 . . . . 0.0 110.707 -179.944 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.27 -57.55 7.43 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.48 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.17 -37.86 36.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.658 0.266 . . . . 0.0 111.415 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.63 -52.69 64.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.911 0.386 . . . . 0.0 110.758 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.446 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -66.07 -33.55 76.05 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.12 179.588 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -66.3 -28.92 69.06 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.432 -178.827 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 53.5 mt -100.09 -27.14 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.849 0.357 . . . . 0.0 111.567 -179.026 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.445 HD12 ' HB3' ' A' ' 27' ' ' LEU . 1.1 tt -58.39 -30.95 41.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.023 -178.943 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -68.38 -21.24 74.12 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.513 -179.299 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -70.57 -25.21 62.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.888 0.344 . . . . 0.0 111.9 -179.318 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -69.68 -35.22 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -179.45 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.62 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 41.3 mt-30 64.99 17.62 11.16 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.058 0.456 . . . . 0.0 110.354 -179.964 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -89.56 164.08 14.93 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.236 -179.702 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -62.9 -36.74 84.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.079 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -68.23 -9.21 45.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.712 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.434 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -102.6 -1.77 29.67 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.479 -179.615 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.6 t -87.57 -35.08 7.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.15 -179.761 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.535 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.6 tm-20 -60.41 -49.6 89.58 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.504 -179.679 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.535 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 71.7 Cg_exo -48.19 -50.48 11.94 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.041 1.827 . . . . 0.0 111.993 179.548 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 73' ' ' ALA . 11.0 mt -57.86 -30.22 65.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.777 -179.381 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 31.4 mm -62.43 -59.1 4.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -70.08 -36.09 74.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.744 0.307 . . . . 0.0 111.485 -179.423 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.671 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -54.6 -55.42 29.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.171 -179.176 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.725 HD13 HD22 ' A' ' 92' ' ' LEU . 16.7 mt -53.91 -12.25 0.54 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.721 0.296 . . . . 0.0 111.188 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -114.29 -15.46 12.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.375 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.1 -41.2 96.25 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.329 0.585 . . . . 0.0 111.256 -179.281 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.664 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 24.1 t70 61.11 28.25 17.97 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.778 -179.845 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.506 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 56.4 m -82.14 1.11 37.74 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.119 -179.334 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.59 -86.78 1.54 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.528 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -62.65 -44.06 97.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.04 0.448 . . . . 0.0 110.26 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.671 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.8 t -71.2 -39.93 73.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.158 -179.896 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.664 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 5.2 ttm180 -68.29 -62.27 1.47 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.688 179.987 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.8 t -53.7 -26.43 22.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.802 179.561 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.34 -46.87 91.34 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.933 179.596 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.452 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -66.93 -28.58 68.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.702 0.286 . . . . 0.0 110.976 179.516 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.58 -43.89 96.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.815 -179.701 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 3.8 ptp180 -83.05 -37.08 24.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.826 179.808 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.6 m -53.22 -41.31 65.22 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.099 179.887 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 73' ' ' ALA . 78.4 mt -55.4 -59.32 4.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.888 0.375 . . . . 0.0 110.138 179.049 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -51.88 -32.65 33.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.811 178.74 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 18.9 mt-30 -66.42 -31.09 71.64 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-O 120.945 0.402 . . . . 0.0 110.366 179.652 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.62 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 90.6 mt -75.91 -61.54 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.464 -179.721 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 57.81 110.63 0.01 OUTLIER Glycine 0 CA--C 1.52 0.389 0 C-N-CA 120.995 -0.622 . . . . 0.0 113.157 179.891 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 150.82 -165.65 30.2 Favored Glycine 0 C--N 1.33 0.25 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.723 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.577 ' HG3' HH21 ' A' ' 86' ' ' ARG . 1.9 mp0 -72.21 -40.59 67.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.94 0.4 . . . . 0.0 110.643 179.735 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.51 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -54.75 -50.98 67.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.476 179.681 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.51 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 9.9 p -70.85 -27.12 29.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.072 179.4 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.577 HH21 ' HG3' ' A' ' 83' ' ' GLU . 7.4 ttp180 -58.66 -30.49 67.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.933 -178.764 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.63 -23.37 27.55 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.79 0.292 . . . . 0.0 111.79 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.5 -37.68 71.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.44 -179.327 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.434 ' SD ' HD23 ' A' ' 108' ' ' LEU . 9.8 ptt? -72.0 -36.7 69.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.55 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -68.38 -45.27 73.18 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.502 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -60.82 -24.92 66.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.708 179.576 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.725 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -86.45 -33.84 20.28 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.403 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.68 -15.23 57.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.062 179.822 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -84.37 -30.3 25.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.94 179.522 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.5 p -119.82 21.56 11.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.394 179.415 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -50.72 127.0 26.71 Favored Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 114.923 -1.035 . . . . 0.0 113.612 -178.896 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 t -144.22 130.17 19.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.751 179.015 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 57.89 -152.31 28.06 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.758 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.468 ' HB3' HH12 ' A' ' 70' ' ' ARG . 49.9 t80 -52.77 -33.13 47.21 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.655 0.264 . . . . 0.0 111.348 -179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.604 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -52.3 -40.31 61.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.741 -179.571 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 -71.78 -52.84 15.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.604 -179.597 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.636 ' HE3' HD22 ' A' ' 106' ' ' ASN . 48.7 tptt -45.61 -26.48 0.61 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.244 0.545 . . . . 0.0 110.51 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 99' ' ' PHE . 45.6 t -66.93 -57.81 8.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.46 179.617 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.607 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -54.62 -62.17 1.83 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.943 0.719 . . . . 0.0 112.943 -179.135 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.451 HG13 ' N ' ' A' ' 106' ' ' ASN . 7.5 p -53.88 -47.1 64.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.721 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.636 HD22 ' HE3' ' A' ' 102' ' ' LYS . 7.0 m-20 -70.79 -35.55 72.61 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.271 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -64.9 -26.18 68.21 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 120.817 0.341 . . . . 0.0 111.385 -178.238 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.434 HD23 ' SD ' ' A' ' 89' ' ' MET . 39.7 mt -49.98 -26.65 4.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.295 179.715 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.53 -6.2 0.67 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.226 -179.399 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 p -114.8 -74.23 0.62 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 13.0 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.916 -179.834 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.471 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.458 -0.048 0 CA-C-O 120.776 0.322 . . . . 0.0 110.709 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.506 ' CE2' ' HB3' ' A' ' 53' ' ' ARG . 1.1 t80 -59.15 -53.17 61.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.515 179.453 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.453 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 4.2 mm-40 -63.51 -57.13 21.21 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.629 179.106 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.471 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 32.9 Cg_exo -50.06 -21.96 7.16 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 121.993 1.795 . . . . 0.0 110.892 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.671 HD21 HG13 ' A' ' 46' ' ' ILE . 1.3 tp -79.31 -42.89 24.71 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 114.632 -1.167 . . . . 0.0 109.87 179.717 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.621 HD12 HD12 ' A' ' 31' ' ' LEU . 18.5 tp -75.6 -21.06 58.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.108 178.844 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 15.4 mm-40 -76.45 -40.69 49.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.519 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.403 ' O ' ' HB3' ' A' ' 33' ' ' ASN . 72.6 p -66.24 -16.29 63.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.491 -179.83 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.621 HD12 HD12 ' A' ' 28' ' ' LEU . 78.2 mt -65.71 -8.71 22.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.727 0.298 . . . . 0.0 111.129 179.955 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.4 t -95.08 8.96 41.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.733 179.71 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.459 HD22 ' HB3' ' A' ' 35' ' ' ASP . 0.6 OUTLIER -81.08 128.84 34.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.169 -179.808 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.17 -27.11 65.37 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.276 -179.084 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.459 ' HB3' HD22 ' A' ' 33' ' ' ASN . 36.7 t70 -75.85 163.0 27.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.793 0.33 . . . . 0.0 111.075 -179.59 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 13.5 p90 -107.67 -31.89 7.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.29 -179.847 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -59.72 -39.03 83.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.0 mt -80.52 -44.75 21.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.828 179.841 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -65.12 -19.56 66.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.741 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.76 -66.44 2.63 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.531 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.1 -35.78 7.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.795 0.331 . . . . 0.0 111.206 179.755 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.2 -49.45 77.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.54 179.622 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.406 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -68.12 -34.55 76.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.783 179.452 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -67.23 -27.86 67.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.012 -179.234 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.6 mt -99.16 -28.79 3.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.78 0.324 . . . . 0.0 111.617 -179.256 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.671 HG13 HD21 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -60.86 -28.7 43.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.176 -179.32 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -69.4 -24.73 75.98 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.27 179.666 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -64.68 -32.97 74.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.775 0.321 . . . . 0.0 110.463 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.469 ' C ' ' H ' ' A' ' 51' ' ' ASP . 17.8 m-85 -92.32 108.7 20.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.441 179.581 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.0 mp0 -76.58 31.26 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.035 0.445 . . . . 0.0 111.005 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 49' ' ' PHE . 20.8 t70 -85.52 160.32 19.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.903 -179.931 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.98 -40.28 97.27 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.795 -179.316 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.506 ' HB3' ' CE2' ' A' ' 24' ' ' PHE . 39.6 ttm180 -65.33 -12.28 50.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.133 -179.839 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.52 ' O ' HD13 ' A' ' 58' ' ' LEU . . . -106.11 8.94 32.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.134 -179.143 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 51' ' ' ASP . 40.9 t -92.1 -41.73 13.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.213 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.515 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 5.8 tp10 -55.9 -49.17 94.49 Favored Pre-proline 0 C--N 1.331 -0.236 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.088 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.515 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 97.0 Cg_exo -44.24 -52.93 5.23 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.22 1.947 . . . . 0.0 112.055 -179.963 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 54' ' ' ALA . 6.8 mp -51.44 -40.32 59.15 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.888 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.9 mm -59.82 -60.83 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.983 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -70.06 -22.35 63.08 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -179.233 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.686 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -76.23 -44.92 35.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -177.966 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.71 ' HB3' HD11 ' A' ' 92' ' ' LEU . 31.3 mt -62.21 -9.2 7.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.117 0.484 . . . . 0.0 110.698 -179.032 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -127.38 -2.54 6.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.652 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.483 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 47.7 t0 -61.36 -33.89 74.39 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.338 -179.766 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.659 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 3.7 m-20 59.79 25.68 14.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.796 -179.548 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.533 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.9 m -86.29 8.65 20.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.42 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 74.31 -94.31 0.82 Allowed Glycine 0 C--N 1.333 0.361 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.701 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.66 -42.19 78.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.975 0.417 . . . . 0.0 110.502 179.892 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.686 HG12 ' HG ' ' A' ' 61' ' ' LEU . 25.7 t -71.66 -33.19 48.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.726 -179.666 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.659 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 47.6 ttt180 -73.26 -61.23 1.89 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.01 -179.934 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.2 m -51.65 -30.17 20.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.993 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.51 -43.7 95.84 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.35 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.533 ' HA ' ' HB2' ' A' ' 76' ' ' SER . . . -72.35 -34.04 67.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.795 0.331 . . . . 0.0 110.832 179.718 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.515 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -53.65 -44.11 69.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.567 179.759 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.4 ptp85 -83.02 -28.2 29.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.367 179.348 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.533 ' HB2' ' HA ' ' A' ' 73' ' ' ALA . 58.7 m -62.29 -20.98 64.86 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.189 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.567 HD21 HD11 ' A' ' 62' ' ' LEU . 4.9 mt -66.34 -61.26 2.1 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.734 0.302 . . . . 0.0 110.437 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -61.45 -22.28 64.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.761 178.685 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.511 ' HB2' ' HA ' ' A' ' 76' ' ' SER . 0.0 OUTLIER -65.74 -37.85 87.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.165 179.307 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.506 ' HB ' HG21 ' A' ' 85' ' ' VAL . 77.6 mt -87.61 -60.89 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.085 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.66 125.59 0.02 OUTLIER Glycine 0 C--N 1.331 0.258 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.847 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 147.08 -174.13 26.99 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.992 179.743 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -72.21 -22.11 61.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.939 0.4 . . . . 0.0 111.097 -179.889 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.587 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -71.18 -46.75 60.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.872 -179.935 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.55 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 12.1 t -70.73 -26.64 28.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.447 179.898 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ppt_? -58.69 -20.03 44.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.445 -179.528 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -82.29 -30.56 30.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.595 179.457 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.25 -40.32 74.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.194 179.801 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.502 ' O ' ' HB1' ' A' ' 104' ' ' ALA . 16.1 ptt? -71.18 -39.18 72.0 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.723 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -64.73 -26.65 68.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.988 0.423 . . . . 0.0 109.899 179.028 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -64.72 -48.01 76.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.23 179.325 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.71 HD11 ' HB3' ' A' ' 62' ' ' LEU . 54.5 mt -68.49 -35.07 77.0 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.403 179.39 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.477 ' HA ' ' CZ ' ' A' ' 101' ' ' ARG . . . -55.18 -33.56 63.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.834 179.058 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -96.99 -11.92 23.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.155 179.681 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.1 m -92.24 -28.62 16.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.951 0.405 . . . . 0.0 111.065 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 62.7 113.3 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.62 -179.642 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.619 ' H ' ' HB2' ' A' ' 101' ' ' ARG . 14.1 p -146.56 -176.58 5.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.734 0.302 . . . . 0.0 111.032 -179.533 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -83.69 -83.71 0.92 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.512 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.442 ' O ' HG23 ' A' ' 103' ' ' VAL . 58.2 t80 -78.52 -40.35 35.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.746 0.307 . . . . 0.0 111.01 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.414 ' HB3' ' OG1' ' A' ' 97' ' ' THR . . . -57.01 -43.32 81.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.651 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.619 ' HB2' ' H ' ' A' ' 97' ' ' THR . 23.8 tpt85 -59.9 -61.39 2.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.497 -179.384 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 54.2 tttt -50.13 -37.37 33.92 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.174 0.511 . . . . 0.0 110.118 179.63 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.515 HG21 ' HB1' ' A' ' 74' ' ' ALA . 11.9 t -61.5 -41.86 91.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.902 179.369 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.502 ' HB1' ' O ' ' A' ' 89' ' ' MET . . . -64.88 -59.75 3.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.139 -179.473 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.451 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 4.4 p -58.96 -47.16 90.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.819 -178.969 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.437 ' N ' HG13 ' A' ' 105' ' ' VAL . 37.0 t30 -64.67 -32.57 74.29 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.559 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -62.45 -26.92 68.77 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 120.666 0.27 . . . . 0.0 111.143 -178.976 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -51.94 -26.2 9.9 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.25 179.766 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -55.35 -18.37 6.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.284 179.887 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.0 m -101.99 -74.72 0.62 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.936 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 44.2 m80 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.69 179.576 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.406 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 CA--C 1.528 0.106 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.462 ' CE1' ' HB3' ' A' ' 53' ' ' ARG . 2.1 t80 -57.96 -51.34 70.06 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.3 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.457 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -63.37 -57.8 18.56 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.231 179.508 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HD3' ' HB2' ' A' ' 25' ' ' GLU . 83.3 Cg_exo -46.57 -25.2 3.3 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 122.065 1.843 . . . . 0.0 111.467 -179.706 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 19.7 mt -77.5 -46.54 22.12 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.894 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.625 HD12 HD12 ' A' ' 31' ' ' LEU . 27.3 tp -68.47 -19.8 64.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.918 178.855 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.58 -23.82 53.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.469 179.824 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.5 m -66.39 -24.08 66.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.132 -179.675 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.625 HD12 HD12 ' A' ' 28' ' ' LEU . 85.3 mt -65.34 -10.77 35.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.842 0.353 . . . . 0.0 110.643 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.6 t -88.67 8.37 28.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.534 179.851 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -102.32 130.04 48.94 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.33 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -68.27 -4.03 12.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.966 179.366 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -77.6 150.54 34.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.734 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 46.9 m0 -88.04 -46.25 9.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.965 -179.973 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -60.29 -37.22 79.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.238 -179.806 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.9 mt -75.03 -57.28 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.244 -179.781 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.564 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 24.7 ttm180 -59.03 -23.22 61.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.066 -179.857 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.402 ' HA2' ' HA ' ' A' ' 69' ' ' VAL . . . -77.06 -59.07 3.24 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.767 -179.741 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.69 8.37 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.763 0.316 . . . . 0.0 111.502 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.82 -56.53 20.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.769 179.741 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.454 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -65.79 -35.37 80.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.833 179.359 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -55.37 -33.37 63.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.673 -179.582 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 46.7 mm -99.5 -23.04 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.244 0.545 . . . . 0.0 110.758 -179.835 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.623 HG23 ' HB1' ' A' ' 54' ' ' ALA . 1.0 OUTLIER -60.04 -32.53 50.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.767 -179.209 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.59 -22.2 77.87 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.608 -0.806 . . . . 0.0 113.092 -179.31 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -70.74 -8.12 49.87 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.19 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -94.97 -26.81 15.95 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.566 ' HG3' HD12 ' A' ' 80' ' ' ILE . 19.2 mp0 57.76 30.52 19.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.995 0.426 . . . . 0.0 111.005 -179.577 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.412 ' O ' HG23 ' A' ' 55' ' ' VAL . 23.6 t70 -102.43 161.02 14.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.995 -179.822 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -62.44 -37.98 88.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.066 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.462 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 17.9 ttm180 -67.09 -9.0 34.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.586 179.741 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.623 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -103.74 -9.63 18.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.86 -179.26 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 51' ' ' ASP . 68.1 t -82.91 -35.16 12.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.245 -179.827 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.607 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 26.9 tt0 -60.27 -51.37 80.72 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.778 -179.454 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.607 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 54.1 Cg_exo -52.5 -34.86 64.03 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.148 1.898 . . . . 0.0 112.595 179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.537 ' HA ' ' HB2' ' A' ' 73' ' ' ALA . 8.7 mt -72.18 -27.27 62.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.202 -179.339 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 33.3 mm -63.05 -59.75 3.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.315 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -70.03 -7.02 37.63 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -178.342 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.764 ' HG ' HG12 ' A' ' 69' ' ' VAL . 3.1 mp -89.84 -40.57 12.35 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -177.997 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.833 HD11 HD11 ' A' ' 77' ' ' LEU . 4.3 mt -59.68 -14.81 15.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.278 0.561 . . . . 0.0 110.244 -178.888 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -104.46 -27.93 11.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.441 179.136 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.46 ' O ' ' HB2' ' A' ' 70' ' ' ARG . 34.2 t70 -59.77 138.31 57.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.853 -179.765 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -110.74 39.04 2.32 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.043 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 67.2 m -86.49 -30.68 21.79 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.283 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 115.54 -92.06 0.57 Allowed Glycine 0 C--N 1.329 0.175 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.032 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -57.96 -31.55 66.99 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.191 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.764 HG12 ' HG ' ' A' ' 61' ' ' LEU . 22.7 t -69.16 -51.2 45.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.05 179.829 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 57.9 ttp180 -61.02 -58.59 7.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.641 -179.816 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 63.9 m -51.05 -27.09 7.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.867 -179.043 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.61 -56.04 26.73 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.292 179.902 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.537 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . . . -60.2 -38.66 83.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.909 0.336 . . . . 0.0 111.909 179.767 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.05 -44.42 67.42 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -178.71 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.46 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 7.7 ptp180 -84.57 -35.42 22.81 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.269 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.523 ' HA ' HE21 ' A' ' 79' ' ' GLN . 67.4 m -63.39 -36.05 82.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.048 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.833 HD11 HD11 ' A' ' 62' ' ' LEU . 34.5 mt -61.76 -61.07 2.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.571 0.224 . . . . 0.0 111.221 -179.902 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.434 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 38.1 tt0 -62.25 -19.9 63.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.049 0.452 . . . . 0.0 110.395 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.523 HE21 ' HA ' ' A' ' 76' ' ' SER . 8.2 tt0 -62.83 -25.22 68.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.498 179.668 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.566 HD12 ' HG3' ' A' ' 50' ' ' GLN . 2.5 mm -90.79 -60.14 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.056 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.03 98.27 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.775 -0.648 . . . . 0.0 112.46 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 169.35 -174.15 43.73 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.46 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -70.93 -23.85 62.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.736 0.303 . . . . 0.0 110.673 -179.856 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.504 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -62.7 -53.16 58.72 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.646 179.866 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.697 HG13 HD22 ' A' ' 77' ' ' LEU . 93.6 t -70.65 -24.69 25.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.943 0.401 . . . . 0.0 110.692 179.217 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.3 -27.48 35.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.615 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.86 -30.21 23.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.442 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.13 -38.85 72.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.242 179.894 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.818 ' HE2' HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -68.64 -32.84 72.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.671 179.434 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -64.9 -42.51 94.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.316 179.3 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -58.73 -38.17 77.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.084 179.793 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.644 HD22 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -86.54 -23.11 25.97 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.462 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.27 -21.32 62.11 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.528 179.641 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.47 -26.03 38.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.684 179.591 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 82.4 p -119.59 22.93 11.44 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.248 178.775 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -54.38 123.3 27.48 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.009 -0.996 . . . . 0.0 113.594 -178.781 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.0 t -145.95 130.04 17.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.46 -0.37 . . . . 0.0 110.684 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.09 -139.07 47.99 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.066 -0.588 . . . . 0.0 112.879 -179.76 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -60.8 -31.55 70.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.811 0.338 . . . . 0.0 111.088 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.578 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -54.1 -42.52 69.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.913 -179.404 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -67.11 -58.49 4.78 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -178.929 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.0 ttmp? -45.52 -30.04 1.33 Allowed 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.046 0.451 . . . . 0.0 110.885 -179.497 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.477 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 12.2 t -60.24 -57.08 13.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.236 179.511 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.624 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -63.74 -53.59 48.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.283 -179.194 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.8 t -61.28 -62.01 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -178.195 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -55.61 -29.4 59.08 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -178.124 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.434 ' CE1' ' HA ' ' A' ' 78' ' ' GLU . 3.0 t80 -58.84 -32.96 69.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.927 0.394 . . . . 0.0 110.635 -179.479 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.818 HD11 ' HE2' ' A' ' 89' ' ' MET . 37.6 mt -55.28 -23.44 23.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.606 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.98 6.66 8.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.599 -179.826 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.7 m -126.44 -74.93 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.428 -179.863 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.579 -179.959 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.627 0.251 . . . . 0.0 111.378 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.555 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 4.7 t80 -53.91 -53.8 47.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.692 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -63.55 -56.06 29.51 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.362 179.0 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.497 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 83.7 Cg_exo -45.34 -27.52 3.2 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.118 1.879 . . . . 0.0 111.821 179.593 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.596 HD13 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -64.89 -59.14 4.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.756 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 25' ' ' GLU . 4.2 pp -68.53 -19.23 64.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.109 0.48 . . . . 0.0 110.161 178.993 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.455 ' N ' HD12 ' A' ' 28' ' ' LEU . 40.3 tt0 -69.65 -34.69 74.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.453 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.7 t -66.42 -14.99 62.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.383 -179.827 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.538 HD11 ' HG3' ' A' ' 57' ' ' PRO . 95.9 mt -65.65 -10.26 34.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.804 0.335 . . . . 0.0 110.801 179.858 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.3 m -113.61 12.61 18.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.065 -179.936 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -78.68 143.05 36.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.847 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -67.79 -25.41 65.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.06 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -87.56 135.06 33.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.953 -179.965 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 27.9 p-90 -82.24 -35.22 28.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.991 -179.897 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.451 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 40.7 ttp180 -58.73 -30.7 67.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.151 179.785 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.0 mm -82.79 -41.19 17.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.353 179.884 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.459 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 39.6 ttm180 -63.63 -40.14 96.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.553 -179.362 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.527 ' HA2' HG13 ' A' ' 69' ' ' VAL . . . -59.09 -60.55 8.67 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.3 -179.892 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.12 -27.79 2.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.638 0.256 . . . . 0.0 111.317 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 39' ' ' ARG . . . -58.94 -56.33 23.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.839 179.611 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.511 ' HB1' HD23 ' A' ' 58' ' ' LEU . . . -68.94 -25.33 64.5 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.758 0.313 . . . . 0.0 111.215 179.946 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.6 m95 -55.44 -44.96 76.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.054 -179.453 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.9 mm -99.95 -21.07 5.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.022 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.634 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.9 tt -58.21 -30.77 40.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.765 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.494 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -65.39 -16.72 63.2 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.955 -179.399 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.421 ' CG ' HE22 ' A' ' 79' ' ' GLN . 2.1 m-20 -70.81 -25.04 62.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.641 0.258 . . . . 0.0 111.617 -179.573 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -72.18 -23.63 61.3 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.721 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 56.84 26.21 11.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.932 0.396 . . . . 0.0 111.425 179.83 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -101.99 160.54 14.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.218 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.533 ' O ' HG22 ' A' ' 55' ' ' VAL . 9.8 pt-20 -65.58 -34.14 77.54 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.247 0.546 . . . . 0.0 110.62 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 18.7 ttm180 -69.36 -10.24 57.01 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.415 179.204 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.418 ' C ' ' HD2' ' A' ' 57' ' ' PRO . . . -104.11 -21.07 13.63 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.795 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.533 HG22 ' O ' ' A' ' 52' ' ' GLU . 19.4 m -76.61 -35.99 26.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.113 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.588 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 31.7 tt0 -57.8 -51.88 78.5 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 111.49 0.181 . . . . 0.0 111.49 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.634 ' HG2' HD13 ' A' ' 46' ' ' ILE . 66.6 Cg_exo -52.03 -23.43 16.99 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.131 1.888 . . . . 0.0 112.151 179.399 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.554 HD22 ' HA ' ' A' ' 73' ' ' ALA . 50.6 mt -80.02 -35.97 36.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.496 179.713 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.24 -54.27 37.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.028 -179.588 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -70.12 -14.43 62.65 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -178.366 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.734 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 tp -90.05 -27.45 19.7 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.442 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.632 HD11 HD11 ' A' ' 77' ' ' LEU . 10.1 mt -65.81 -9.77 31.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.139 0.495 . . . . 0.0 110.475 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -121.7 1.8 10.01 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.071 -179.683 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -61.01 -32.15 71.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.19 0.519 . . . . 0.0 111.289 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 52.47 28.65 6.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.333 -0.849 . . . . 0.0 112.02 179.833 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.498 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 7.4 t -85.33 -25.45 27.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.983 0.421 . . . . 0.0 110.818 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.65 -108.83 0.99 Allowed Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.966 -179.832 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.451 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.9 OUTLIER -59.7 -27.46 66.45 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.974 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.734 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.8 t -66.99 -34.54 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.932 178.968 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -75.73 -49.33 18.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.994 179.16 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 56.7 m -67.1 -21.37 65.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.996 179.414 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -62.74 -63.39 4.67 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.301 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.554 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -55.23 -25.77 35.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.879 0.371 . . . . 0.0 111.124 179.348 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.49 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.78 -58.28 8.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.55 -179.63 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -64.6 -37.59 88.1 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.324 -179.729 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.494 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 38.6 m -55.79 -38.38 69.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.208 -179.694 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.632 HD11 HD11 ' A' ' 62' ' ' LEU . 15.8 mt -69.73 -60.02 2.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.666 179.303 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.433 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 29.9 mt-10 -51.7 -25.93 8.29 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.245 0.545 . . . . 0.0 109.927 178.436 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' A' ' 76' ' ' SER . 47.6 tt0 -70.11 -44.09 69.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.904 179.164 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.447 ' HB ' HG11 ' A' ' 85' ' ' VAL . 79.9 mt -57.59 -58.43 6.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.201 178.901 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.495 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 70.29 135.41 0.1 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.915 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 124.73 174.81 14.11 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.828 179.685 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -61.79 -22.91 65.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.989 0.423 . . . . 0.0 110.551 179.562 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.563 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -55.13 -63.21 1.23 Allowed 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.829 -179.896 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.447 HG11 ' HB ' ' A' ' 80' ' ' ILE . 5.2 m -70.28 -24.55 25.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.815 179.819 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -55.86 -28.71 57.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.498 -178.566 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.19 -26.44 26.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.861 0.363 . . . . 0.0 110.706 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.48 -46.18 60.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.087 179.918 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.58 ' N ' ' HE2' ' A' ' 89' ' ' MET . 0.0 OUTLIER -72.11 -37.45 69.52 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 179.828 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -55.56 -37.15 67.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.95 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -81.52 -20.96 38.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.901 179.328 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.555 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -83.21 -26.13 31.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.663 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.66 -24.85 67.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.728 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -80.04 -22.7 42.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.293 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 30.2 p -120.39 15.93 12.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.173 179.227 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -56.33 127.55 43.92 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 114.794 -1.093 . . . . 0.0 113.468 -178.936 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.0 t -139.78 130.3 25.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.963 0.411 . . . . 0.0 110.55 178.991 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.6 -132.03 51.29 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.705 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -69.49 -33.92 73.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.635 0.255 . . . . 0.0 111.589 -179.716 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.473 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -49.79 -33.01 15.28 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.008 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.404 ' C ' ' N ' ' A' ' 103' ' ' VAL . 49.9 ttp180 -79.76 -52.52 7.82 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -178.823 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -45.91 -23.24 0.27 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.263 0.554 . . . . 0.0 110.429 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.49 HG21 ' HB1' ' A' ' 74' ' ' ALA . 55.6 t -71.47 -60.24 2.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.341 179.664 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.542 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -54.06 -49.95 67.85 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.208 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.0 t -64.87 -63.23 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.215 -0.902 . . . . 0.0 113.008 -177.615 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -55.39 -46.29 76.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.626 -178.379 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.495 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 39.2 t80 -60.0 -37.54 80.02 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.196 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.579 ' O ' HD12 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -49.82 -25.31 2.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.373 -178.116 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.2 6.27 1.02 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.683 -179.767 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 76.8 p -96.4 -71.24 0.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.595 0.236 . . . . 0.0 111.445 -179.887 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 62.4 t-80 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.805 179.964 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.593 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.231 0.093 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.531 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -61.04 -51.12 70.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.984 0.421 . . . . 0.0 110.584 179.904 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -62.94 -52.99 59.5 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.1 179.806 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.593 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 74.3 Cg_exo -40.61 -28.93 0.36 Allowed 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 122.257 1.972 . . . . 0.0 111.722 179.285 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 49.2 mt -72.64 -55.04 7.46 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.101 178.714 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.698 HD12 HD12 ' A' ' 31' ' ' LEU . 23.8 tp -63.09 -22.9 67.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.167 179.021 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -83.18 -34.17 26.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.996 179.763 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.3 t -66.23 -16.18 63.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.901 179.772 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.698 HD12 HD12 ' A' ' 28' ' ' LEU . 80.3 mt -63.4 -13.22 37.42 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.877 -179.999 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 90.3 p -100.64 22.34 12.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.773 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.01 146.18 27.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.963 -179.827 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -66.44 -20.9 66.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.385 -179.784 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -83.87 162.8 20.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.379 . . . . 0.0 111.176 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 14.5 p90 -103.11 -40.34 6.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.175 -179.997 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -61.72 -30.34 70.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.137 -179.924 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 31.8 mm -78.51 -42.05 25.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.452 -179.431 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.445 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 41.6 ttm180 -62.96 -44.7 95.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.302 -179.632 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.24 -57.92 12.05 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.892 -179.679 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.89 -28.9 4.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.718 0.294 . . . . 0.0 111.582 -179.811 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.439 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -63.7 -50.56 68.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.951 179.862 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.57 ' CB ' HD22 ' A' ' 61' ' ' LEU . . . -74.82 -25.23 58.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.432 -179.893 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -60.63 -37.98 83.25 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.408 -179.878 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.2 mm -99.53 -19.77 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.799 -179.397 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.469 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.3 tt -59.81 -36.79 68.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -178.417 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.445 ' HA2' HD11 ' A' ' 80' ' ' ILE . . . -70.97 -7.44 62.27 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.465 -0.874 . . . . 0.0 113.39 -179.099 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -70.78 -26.45 63.34 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -179.241 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -87.03 -27.03 23.44 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.813 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.571 ' HG3' HD13 ' A' ' 80' ' ' ILE . 19.0 mp0 60.74 60.94 1.78 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.76 0.314 . . . . 0.0 111.524 -179.607 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -127.99 176.95 7.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.787 179.47 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -64.22 -34.23 77.61 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.931 179.777 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.523 ' HA ' ' HE ' ' A' ' 53' ' ' ARG . 1.8 mmp_? -68.56 -11.44 59.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.252 -179.899 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.39 10.38 33.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.956 -179.342 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.5 t -91.54 -58.49 3.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.056 -179.275 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.434 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 39.4 tt0 -60.5 -46.28 97.37 Favored Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.094 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.543 ' HG3' HD13 ' A' ' 28' ' ' LEU . 95.2 Cg_exo -43.67 -48.08 9.07 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.191 1.927 . . . . 0.0 112.647 -179.898 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.486 HD22 ' HA ' ' A' ' 73' ' ' ALA . 10.3 mt -59.74 -36.51 76.76 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.276 -179.477 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.695 HD11 ' HB1' ' A' ' 88' ' ' ALA . 40.2 mm -61.39 -61.15 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.181 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.527 ' HD2' HD13 ' A' ' 31' ' ' LEU . 5.9 ptpt -70.25 -11.91 61.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.978 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.656 HD23 ' H ' ' A' ' 73' ' ' ALA . 1.3 tp -89.97 -45.75 8.98 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -177.821 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.491 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 3.9 pp -67.26 -8.38 31.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 111.291 -178.438 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -101.71 -4.32 26.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.189 -179.877 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.436 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 2.1 m-20 -61.3 -33.85 74.25 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.61 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.616 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 38.4 m-20 59.6 27.58 16.82 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.183 -179.35 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.491 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 11.7 m -82.12 -31.83 30.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.59 -179.335 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 135.78 -109.36 0.74 Allowed Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.792 -179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -58.14 -28.71 64.95 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.757 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.491 ' HB ' ' HB2' ' A' ' 66' ' ' SER . 49.4 t -65.5 -45.9 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.477 178.688 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.616 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 53.0 ttp180 -62.0 -48.88 78.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.389 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.9 m -67.12 -24.8 65.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.205 -179.993 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -55.37 -69.78 1.16 Allowed Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.386 -179.903 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.656 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -47.56 -31.98 4.94 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 179.295 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.86 -47.64 84.1 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.26 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -71.29 -40.3 70.95 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.157 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.537 ' O ' HG12 ' A' ' 80' ' ' ILE . 6.7 p -54.46 -27.85 40.37 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.692 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.659 ' HB3' HG11 ' A' ' 85' ' ' VAL . 17.6 mt -55.12 -60.69 3.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.743 0.306 . . . . 0.0 110.696 179.944 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 34.2 mt-10 -48.88 -36.9 18.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.989 178.262 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.446 ' OE1' ' HA ' ' A' ' 76' ' ' SER . 96.2 mt-30 -67.3 -30.4 70.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.855 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.571 HD13 ' HG3' ' A' ' 50' ' ' GLN . 50.6 mm -80.1 -60.48 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.337 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.597 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . 150.45 142.89 3.63 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.479 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 86' ' ' ARG . . . -69.27 -50.03 35.66 Favored Glycine 0 C--O 1.223 -0.569 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.16 -179.475 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -55.27 -35.94 65.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.586 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.597 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.0 OUTLIER -86.2 -58.59 2.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.005 0.431 . . . . 0.0 111.484 -179.046 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.659 HG11 ' HB3' ' A' ' 77' ' ' LEU . 75.7 t -60.09 -21.75 22.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.734 -179.489 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 12.1 ttp180 -52.95 -31.17 38.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.926 0.393 . . . . 0.0 110.608 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.05 -33.29 70.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.775 179.219 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.695 ' HB1' HD11 ' A' ' 59' ' ' ILE . . . -71.58 -46.27 59.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.441 179.444 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.621 ' HE3' HD23 ' A' ' 92' ' ' LEU . 24.8 mmm -63.08 -48.95 76.42 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.819 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -51.27 -33.27 27.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.617 178.829 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 60.7 tptt -79.03 -26.41 43.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.0 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.625 HD21 ' O ' ' A' ' 100' ' ' ALA . 2.0 tp -82.29 -25.55 33.89 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.566 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.93 -22.5 65.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.269 0.557 . . . . 0.0 109.604 178.897 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -80.25 -29.75 38.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.556 179.041 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 15.5 p -108.61 19.05 20.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.673 178.97 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.508 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -51.51 114.14 2.82 Favored Glycine 0 N--CA 1.447 -0.597 0 CA-C-N 115.237 -0.892 . . . . 0.0 113.235 -179.117 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.0 t -139.8 130.1 25.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.857 0.36 . . . . 0.0 110.799 179.348 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.29 -127.85 44.59 Favored Glycine 0 CA--C 1.519 0.326 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.862 179.929 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.485 ' O ' HG23 ' A' ' 103' ' ' VAL . 24.6 t80 -74.04 -31.52 62.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.71 0.29 . . . . 0.0 111.278 -179.808 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.625 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.66 -37.05 48.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.032 -179.248 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.508 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 29.6 ttt180 -67.37 -58.61 4.46 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.371 -179.535 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -47.03 -24.77 0.68 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.788 -179.973 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 55.6 t -66.01 -60.67 2.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.506 179.846 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.584 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -59.26 -39.66 83.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.901 -179.559 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 38.5 t -64.94 -58.22 8.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.69 -0.687 . . . . 0.0 112.445 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -68.76 -43.33 76.01 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -178.03 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.553 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 62.6 t80 -60.83 -45.6 93.83 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -178.41 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.504 ' HB3' ' O ' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -50.13 -19.66 0.81 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.709 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -71.27 6.58 1.64 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.765 179.423 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 26.5 p -92.91 -40.46 10.59 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.017 0.436 . . . . 0.0 110.109 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.985 179.333 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.668 0.271 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.8 t80 -55.33 -53.19 59.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.333 179.5 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.39 -57.05 21.94 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.573 178.996 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.515 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 96.4 Cg_exo -41.74 -33.2 1.84 Allowed 'Trans proline' 0 C--N 1.359 1.109 0 C-N-CA 122.321 2.014 . . . . 0.0 111.607 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 22.8 mt -61.93 -58.25 8.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.927 178.706 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.735 HD12 HD12 ' A' ' 31' ' ' LEU . 11.0 tp -64.75 -21.15 66.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.911 178.693 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -74.38 -33.16 62.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.258 179.828 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.1 m -66.44 -17.34 64.73 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.753 -179.753 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.735 HD12 HD12 ' A' ' 28' ' ' LEU . 81.8 mt -65.49 -6.75 11.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.838 0.352 . . . . 0.0 110.804 179.852 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 53.1 m -121.62 17.07 11.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.356 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.483 HD21 ' HB3' ' A' ' 35' ' ' ASP . 11.4 t30 -88.04 137.19 32.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.858 -179.785 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -53.28 -37.48 62.23 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.584 -179.575 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.483 ' HB3' HD21 ' A' ' 33' ' ' ASN . 16.9 t70 -76.09 133.65 40.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.705 -179.672 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -92.03 -27.27 17.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.363 -179.559 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 -60.61 -36.17 77.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.139 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.8 mt -81.91 -38.92 16.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.17 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.484 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.6 ttm180 -56.43 -26.07 52.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.597 179.85 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.42 -63.27 3.46 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.219 179.723 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.412 ' HA ' ' HB2' ' A' ' 44' ' ' TRP . . . -48.82 -24.36 1.41 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.791 0.329 . . . . 0.0 111.346 179.787 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.426 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.98 -57.17 13.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.348 -179.957 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.16 -24.75 62.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.89 0.376 . . . . 0.0 111.195 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.437 ' NE1' ' HA2' ' A' ' 72' ' ' GLY . 6.5 m95 -55.42 -44.69 76.5 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.253 -178.884 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.4 mt -99.11 -20.4 5.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.755 0.312 . . . . 0.0 111.706 -179.381 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.596 HD13 ' HG2' ' A' ' 57' ' ' PRO . 1.4 tt -55.48 -34.12 33.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.681 -179.086 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.23 -27.57 72.55 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.783 -0.723 . . . . 0.0 113.334 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -70.73 -0.04 8.04 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.356 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -91.51 -38.22 12.66 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 -179.829 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.568 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 69.57 44.96 0.84 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.272 0.558 . . . . 0.0 110.714 179.831 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.447 ' O ' HG23 ' A' ' 55' ' ' VAL . 4.9 m-20 -126.94 164.06 22.29 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.907 -179.843 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -61.57 -40.78 95.98 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.103 -179.866 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.503 ' HG3' HD22 ' A' ' 28' ' ' LEU . 14.0 ttm180 -67.25 -9.65 42.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.798 179.889 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.549 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -104.25 -8.89 19.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.14 -179.003 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 51' ' ' ASP . 71.2 t -91.72 -36.73 8.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.517 -179.767 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.608 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 13.5 tt0 -60.27 -51.93 76.74 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -179.395 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 51.0 Cg_exo -54.99 -17.67 14.87 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 122.273 1.982 . . . . 0.0 112.821 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.516 HD13 HD12 ' A' ' 77' ' ' LEU . 14.5 mt -85.82 -36.06 20.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.965 -179.76 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.6 mm -61.15 -53.34 50.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.801 -179.452 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -70.03 -13.71 62.35 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.88 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.677 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.9 mp -89.86 -36.36 15.11 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -177.961 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.572 HD13 HD22 ' A' ' 92' ' ' LEU . 9.0 mt -63.48 -9.16 11.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.836 0.351 . . . . 0.0 111.132 -178.34 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -111.78 -11.88 13.9 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.365 -179.823 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.424 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 3.0 t70 -61.07 -32.49 72.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.12 0.486 . . . . 0.0 111.111 179.978 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.4 t70 47.61 30.35 1.71 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.793 179.885 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.46 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 22.7 t -86.28 -36.26 19.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.864 0.364 . . . . 0.0 111.426 -179.767 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 130.2 -96.95 0.37 Allowed Glycine 0 C--O 1.228 -0.253 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 -178.875 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.06 -32.61 55.17 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.966 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.677 HG12 ' HG ' ' A' ' 61' ' ' LEU . 16.3 t -73.77 -59.99 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.032 179.286 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.418 ' HA ' ' O ' ' A' ' 61' ' ' LEU . 7.6 tmm_? -69.4 -63.33 1.09 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.675 -179.209 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 22.9 t -51.76 -24.89 6.51 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.005 0.431 . . . . 0.0 110.764 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.437 ' HA2' ' NE1' ' A' ' 44' ' ' TRP . . . -63.51 -61.25 6.43 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.699 -0.762 . . . . 0.0 111.714 179.347 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.51 -25.47 68.04 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.722 0.296 . . . . 0.0 110.973 179.243 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -52.42 -46.26 66.28 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.115 -179.366 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.468 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 11.5 ptp180 -81.34 -30.77 33.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.776 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.521 ' HA ' HE21 ' A' ' 79' ' ' GLN . 14.7 m -53.19 -44.14 67.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.353 -179.673 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.556 HD23 ' HE1' ' A' ' 89' ' ' MET . 9.0 mp -55.47 -59.61 4.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.836 179.766 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -52.37 -31.23 32.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.472 179.489 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.521 HE21 ' HA ' ' A' ' 76' ' ' SER . 34.0 mt-30 -62.95 -36.94 85.13 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.911 0.386 . . . . 0.0 110.395 179.631 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.568 HG23 ' HG3' ' A' ' 50' ' ' GLN . 69.2 mt -71.63 -55.2 14.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.543 179.432 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.564 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 63.12 -175.57 8.22 Favored Glycine 0 N--CA 1.453 -0.218 0 CA-C-N 115.979 -0.555 . . . . 0.0 113.383 179.407 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.595 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 73.49 168.35 14.98 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.349 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.445 ' HG3' HH21 ' A' ' 86' ' ' ARG . 40.2 tt0 -55.65 -21.12 16.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.927 0.394 . . . . 0.0 110.724 179.621 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.595 HH11 ' HA3' ' A' ' 82' ' ' GLY . 2.7 mpt_? -60.84 -65.6 0.66 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.242 -178.855 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.609 HG22 ' HE1' ' A' ' 89' ' ' MET . 2.5 p -70.88 -23.13 23.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.181 0.515 . . . . 0.0 110.105 179.492 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.445 HH21 ' HG3' ' A' ' 83' ' ' GLU . 23.2 ttp180 -54.61 -19.46 6.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.273 -179.815 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -79.56 -36.65 37.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.43 -35.87 72.76 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.606 179.607 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.609 ' HE1' HG22 ' A' ' 85' ' ' VAL . 8.4 mmt -59.23 -62.74 1.66 Allowed 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.86 178.987 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -51.56 -36.55 45.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.93 179.394 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -73.53 -28.16 61.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.589 -179.825 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.662 HD23 ' HB2' ' A' ' 104' ' ' ALA . 2.4 tp -86.19 -27.15 24.71 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.581 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.28 -28.28 64.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.684 179.039 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -80.14 -27.51 39.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.766 179.455 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.4 p -112.16 27.03 10.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.484 179.245 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.546 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -50.53 119.8 7.84 Favored Glycine 0 N--CA 1.448 -0.552 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.818 -178.852 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 t -142.58 130.68 21.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.521 -0.339 . . . . 0.0 110.42 179.05 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.92 -132.37 19.43 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.318 -179.567 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.07 -15.88 23.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.803 0.335 . . . . 0.0 110.588 179.998 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.454 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -56.93 -37.06 70.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.648 179.638 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.546 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 61.0 ttt180 -57.19 -61.28 2.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.343 179.458 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -53.32 -32.8 50.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.309 179.379 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.454 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 9.6 t -62.45 -51.94 66.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.499 179.974 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.662 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -56.15 -62.24 1.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -178.914 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 106' ' ' ASN . 6.0 p -57.77 -53.38 45.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.022 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.502 ' N ' HG13 ' A' ' 105' ' ' VAL . 41.2 t30 -61.83 -39.16 90.83 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -178.787 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.564 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 63.4 t80 -62.16 -23.96 66.9 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 120.836 0.35 . . . . 0.0 111.263 -178.613 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.2 mt -53.65 -22.78 9.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.411 -179.757 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -77.63 7.17 5.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.246 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.0 m -130.05 -52.97 1.12 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.444 -179.548 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.104 -0.95 . . . . 0.0 111.433 -179.95 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.469 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.614 0.245 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.483 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 3.1 t80 -49.44 -44.65 45.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.537 178.902 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -63.48 -56.71 24.31 Favored Pre-proline 0 N--CA 1.465 0.297 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.307 -179.584 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 70.5 Cg_exo -37.39 -25.24 0.06 OUTLIER 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 122.863 2.376 . . . . 0.0 112.759 179.244 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 27.1 mt -72.33 -54.26 9.99 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.742 179.215 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.573 HD23 HD11 ' A' ' 46' ' ' ILE . 12.9 mt -67.96 -26.06 65.75 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.134 179.044 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 11.6 mm-40 -63.72 -41.04 98.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.497 -179.614 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.2 m -66.05 -15.45 63.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.578 -179.765 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.543 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 88.1 mt -67.63 -10.98 57.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.726 0.298 . . . . 0.0 111.056 -179.728 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.5 t -98.09 15.88 22.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.089 -179.868 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.478 ' ND2' ' HB ' ' A' ' 38' ' ' ILE . 23.2 p-10 -86.69 149.63 24.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.96 0.41 . . . . 0.0 111.12 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.74 -37.46 82.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.994 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.13 158.21 32.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.956 -179.796 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 1.5 p90 -106.25 -21.0 13.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.962 179.867 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -64.76 -51.57 61.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.799 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.478 ' HB ' ' ND2' ' A' ' 33' ' ' ASN . 43.0 mt -62.32 -40.41 87.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.439 179.614 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.543 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 31.1 ttm180 -63.12 -20.98 65.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.534 179.56 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.92 -64.53 3.86 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.549 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.56 -36.31 4.57 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.694 0.283 . . . . 0.0 111.498 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.23 -47.94 83.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.992 0.425 . . . . 0.0 110.338 179.438 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.04 -30.91 69.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.112 179.533 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -70.73 -34.01 71.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.519 -178.704 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 35.9 mt -98.32 -19.34 5.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.82 0.343 . . . . 0.0 111.502 -179.464 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.609 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -56.1 -35.63 42.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.136 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.21 -18.48 78.06 Favored Glycine 0 C--N 1.329 0.16 0 C-N-CA 120.566 -0.826 . . . . 0.0 113.592 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -58.16 -34.22 70.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.007 0.403 . . . . 0.0 111.098 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.438 ' C ' ' H ' ' A' ' 51' ' ' ASP . 12.0 m-85 -94.07 118.67 31.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.964 0.411 . . . . 0.0 110.963 179.593 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -72.13 20.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.81 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.438 ' H ' ' C ' ' A' ' 49' ' ' PHE . 28.7 t0 -83.8 137.25 33.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.754 0.311 . . . . 0.0 110.552 179.907 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -10.32 32.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.788 -179.044 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.486 ' HG2' HD11 ' A' ' 28' ' ' LEU . 12.3 ttt180 -62.28 -32.36 73.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.775 0.321 . . . . 0.0 110.652 -179.852 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.609 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -104.8 20.15 19.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.58 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.0 p -73.64 -38.66 52.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.823 0.344 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.452 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 19.2 tt0 -60.29 -53.35 65.71 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.591 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.477 ' O ' HD13 ' A' ' 61' ' ' LEU . 69.7 Cg_exo -38.91 -53.16 2.01 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.494 2.129 . . . . 0.0 112.635 179.702 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.515 ' HB3' HD21 ' A' ' 77' ' ' LEU . 11.6 mt -55.58 -48.29 75.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.5 -179.503 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 35.8 mm -58.03 -54.61 29.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.657 -179.46 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -69.81 -11.96 61.26 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.534 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.64 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.4 OUTLIER -87.46 -47.16 8.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.843 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.655 HD13 HD22 ' A' ' 92' ' ' LEU . 5.6 mt -56.24 -16.91 6.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.12 0.486 . . . . 0.0 110.846 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.06 -12.81 14.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.319 179.951 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.424 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.6 t0 -61.13 -35.52 77.28 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.18 0.514 . . . . 0.0 110.911 -179.958 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.65 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 42.9 m-20 52.59 29.95 7.93 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.747 179.792 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.469 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 43.9 t -84.36 -3.62 58.4 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.82 0.343 . . . . 0.0 111.028 179.892 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.88 -90.64 1.46 Allowed Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.434 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.79 -45.68 89.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.162 0.506 . . . . 0.0 109.801 179.435 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.64 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.3 t -69.19 -42.52 81.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.379 -179.873 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.65 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 0.9 OUTLIER -66.83 -62.84 1.24 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.023 -179.816 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.444 ' HA ' HH21 ' A' ' 70' ' ' ARG . 95.2 p -54.67 -24.94 23.97 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.005 179.715 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.58 -35.19 79.47 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.601 -179.915 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.467 ' O ' HD23 ' A' ' 77' ' ' LEU . . . -73.66 -38.61 64.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.556 0.217 . . . . 0.0 111.073 179.79 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.538 ' HB2' HH22 ' A' ' 70' ' ' ARG . . . -42.49 -42.06 3.17 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.027 -179.04 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -84.14 -31.23 25.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.285 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.7 m -63.06 -46.3 88.14 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.743 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.848 HD12 HG13 ' A' ' 85' ' ' VAL . 3.8 mm? -55.34 -60.93 2.72 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.73 0.3 . . . . 0.0 111.534 -178.909 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -61.25 -27.04 68.17 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.758 0.313 . . . . 0.0 111.459 179.807 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -70.55 -24.57 62.82 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.174 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.428 ' HB ' ' CG2' ' A' ' 85' ' ' VAL . 85.0 mt -74.86 -60.99 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.141 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 179.55 -135.68 2.58 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 119.911 -1.137 . . . . 0.0 113.711 -179.49 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.618 ' H ' HH11 ' A' ' 84' ' ' ARG . . . -127.51 -78.89 0.27 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 121.151 -0.547 . . . . 0.0 112.508 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -58.67 -21.27 53.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.82 0.343 . . . . 0.0 111.766 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.618 HH11 ' H ' ' A' ' 82' ' ' GLY . 4.3 mpt_? -75.97 -62.88 1.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.243 0.544 . . . . 0.0 110.28 -178.715 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.848 HG13 HD12 ' A' ' 77' ' ' LEU . 39.4 t -70.72 -20.43 22.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.988 179.653 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 23.3 ttm180 -46.47 -26.71 0.91 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.746 -179.939 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.5 -36.3 22.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.778 179.794 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.91 -44.26 77.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.36 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.433 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 4.3 ppp? -64.3 -28.69 69.89 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.912 0.387 . . . . 0.0 110.049 179.88 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.418 ' N ' ' SD ' ' A' ' 89' ' ' MET . 22.5 mt-10 -70.42 -37.6 74.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.636 179.015 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.471 ' O ' ' HD3' ' A' ' 91' ' ' LYS . 7.3 tmtm? -66.68 -33.83 76.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.393 179.358 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.655 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -85.84 -27.37 25.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.931 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.28 -30.37 69.41 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.456 179.064 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -80.18 -25.07 39.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.358 179.934 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 61.8 p -110.96 20.89 17.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.14 179.067 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.564 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -51.34 119.19 7.74 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.701 -178.902 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.1 m -152.67 130.27 11.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.545 -0.328 . . . . 0.0 110.503 179.189 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.46 -144.61 49.34 Favored Glycine 0 CA--C 1.518 0.275 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.481 -179.839 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -68.71 -29.33 67.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.81 0.338 . . . . 0.0 110.839 179.882 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.634 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.13 -41.73 49.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.519 -179.911 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.564 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 74.7 ttt180 -67.79 -54.49 18.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.524 -179.549 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -45.79 -28.51 1.08 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.281 -179.771 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.524 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 53.6 t -61.8 -60.19 3.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.057 179.242 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.593 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -53.54 -62.02 1.93 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.274 0.559 . . . . 0.0 111.776 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 46.3 t -54.41 -59.22 2.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.843 -178.643 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -56.84 -32.26 65.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.717 0.294 . . . . 0.0 111.612 -179.17 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.424 ' OH ' ' HA2' ' A' ' 82' ' ' GLY . 3.9 t80 -59.34 -27.88 66.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.047 0.451 . . . . 0.0 110.453 -179.678 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 41.8 mt -56.48 -22.25 31.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.398 179.884 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -56.04 -17.83 7.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.475 -179.887 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.1 p -93.7 -64.63 1.06 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.975 179.723 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.465 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 80.0 m80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.323 -0.846 . . . . 0.0 110.718 179.903 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.469 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.457 -0.102 0 CA-C-O 120.753 0.311 . . . . 0.0 111.653 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.437 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -58.0 -51.77 68.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 179.698 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.428 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.39 -54.02 47.71 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.725 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 89.5 Cg_exo -40.1 -35.94 1.34 Allowed 'Trans proline' 0 C--N 1.362 1.272 0 C-N-CA 122.177 1.918 . . . . 0.0 111.433 -179.955 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 27.1 mt -66.86 -53.91 27.65 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.985 178.501 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 31' ' ' LEU . 35.5 tp -61.65 -19.95 62.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.823 179.34 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -75.73 -43.25 47.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.21 -179.614 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.7 m -65.98 -14.37 61.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.363 -179.689 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.528 HD11 HG13 ' A' ' 46' ' ' ILE . 65.9 mt -70.33 -10.43 58.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.271 -179.918 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.6 p -101.79 10.32 40.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.701 179.795 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -81.65 145.76 30.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.76 -18.13 64.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.893 -179.957 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -77.71 142.15 38.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.921 -179.947 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 12.3 p90 -96.59 -22.2 17.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.148 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -72.2 -37.72 69.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.018 0.437 . . . . 0.0 110.693 -179.981 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.546 ' N ' HD12 ' A' ' 38' ' ' ILE . 1.8 mp -81.66 -36.13 14.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.736 -179.766 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.523 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 20.3 ttm180 -65.19 -25.51 67.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.489 -179.955 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.19 -64.59 3.05 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.509 -179.995 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.65 -39.48 24.38 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.661 0.267 . . . . 0.0 110.911 179.76 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 46' ' ' ILE . . . -57.25 -55.39 35.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.236 179.298 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.44 -33.93 71.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.255 179.209 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -64.97 -30.17 71.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.181 -179.814 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.434 ' O ' ' HB2' ' A' ' 48' ' ' ASN . 66.4 mt -98.73 -18.91 6.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.312 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.528 HG13 HD11 ' A' ' 31' ' ' LEU . 4.5 mm -50.41 -61.19 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.315 -179.234 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.677 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -68.56 -3.42 33.3 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.85 -0.691 . . . . 0.0 113.992 -178.395 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.434 ' HB2' ' O ' ' A' ' 45' ' ' ILE . 3.8 m-20 -70.74 0.22 7.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 117.242 0.521 . . . . 0.0 111.078 -179.964 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -106.07 -23.01 12.73 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -179.747 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.614 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.5 OUTLIER 62.32 20.48 11.83 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.899 0.38 . . . . 0.0 110.946 -179.683 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -96.82 171.9 8.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.149 -179.874 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.427 ' O ' HG12 ' A' ' 55' ' ' VAL . 27.4 tt0 -66.41 -34.12 77.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.161 179.738 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -66.73 -13.23 61.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.963 0.411 . . . . 0.0 111.09 -179.719 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.458 ' HA ' HG23 ' A' ' 46' ' ' ILE . . . -101.68 6.38 41.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.928 -179.304 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 52' ' ' GLU . 1.3 p -92.24 -39.11 11.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.242 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.571 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 35.7 tt0 -60.26 -51.9 76.98 Favored Pre-proline 0 CA--C 1.53 0.211 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -178.99 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.571 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 88.1 Cg_exo -47.07 -49.21 13.07 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 121.881 1.721 . . . . 0.0 111.615 179.507 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.442 HD13 ' HG ' ' A' ' 77' ' ' LEU . 10.3 mt -56.77 -37.37 70.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.376 -179.697 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 55' ' ' VAL . 46.6 mm -61.89 -59.33 4.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.901 0.382 . . . . 0.0 111.985 -179.396 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.3 mmmt -70.02 -9.72 56.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.32 -178.873 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.679 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -87.46 -44.34 11.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -178.327 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.713 HD13 HD22 ' A' ' 92' ' ' LEU . 7.6 mt -59.19 -11.32 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.095 0.474 . . . . 0.0 110.641 -179.119 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -116.03 -14.84 11.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.153 -179.926 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -61.23 -22.95 65.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.248 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.57 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 4.0 p30 41.51 32.28 0.22 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.411 -0.813 . . . . 0.0 112.153 179.786 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.471 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 22.2 t -86.18 -8.73 57.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.195 -179.998 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.89 -86.03 1.09 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.248 -179.765 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.45 -42.95 99.56 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.103 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.679 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.2 t -68.69 -49.29 65.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.338 -179.766 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.57 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 51.5 ttp180 -62.7 -41.48 99.16 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.233 -179.758 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 80.5 p -64.26 -31.51 72.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.995 -179.858 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.21 -28.56 69.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.515 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.576 ' HB2' ' CB ' ' A' ' 61' ' ' LEU . . . -74.3 -58.55 3.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.655 0.264 . . . . 0.0 111.588 -179.844 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.509 ' HA ' HD12 ' A' ' 77' ' ' LEU . . . -60.1 -23.93 64.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.833 -179.204 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.6 ttt-85 -81.39 -47.86 12.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.722 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.677 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 8.7 m -67.22 -30.13 69.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.754 -179.494 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 74' ' ' ALA . 18.3 mt -60.76 -59.81 4.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.833 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -54.45 -36.3 63.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.234 179.392 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -58.93 -37.36 76.51 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.918 0.39 . . . . 0.0 110.913 179.718 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.614 HG12 ' HG3' ' A' ' 50' ' ' GLN . 98.3 mt -71.97 -60.32 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.924 179.856 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 67.96 123.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.632 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.589 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 142.93 175.51 16.11 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.68 179.873 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -65.85 -26.15 67.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.761 0.315 . . . . 0.0 111.11 -179.988 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.589 HH11 ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -61.84 -54.31 43.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.665 -179.405 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.581 HG11 ' HB ' ' A' ' 80' ' ' ILE . 3.4 m -70.71 -23.8 24.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.84 0.352 . . . . 0.0 111.306 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.506 ' HA ' ' HG2' ' A' ' 89' ' ' MET . 68.5 ttt180 -58.64 -40.87 84.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.968 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.78 -33.45 70.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.738 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.22 -34.23 77.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.412 179.526 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.527 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 17.6 mmm -69.27 -55.44 10.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.042 -0.527 . . . . 0.0 109.981 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -54.03 -33.53 57.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.4 179.377 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -79.24 -22.84 44.22 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.683 179.242 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.713 HD22 HD13 ' A' ' 62' ' ' LEU . 1.8 tp -87.16 -30.67 20.87 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.707 179.858 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.77 -32.17 69.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.527 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.473 ' HG3' HG23 ' A' ' 95' ' ' THR . 12.9 pt-20 -80.39 -20.97 42.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.09 0.472 . . . . 0.0 110.15 179.853 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.473 HG23 ' HG3' ' A' ' 94' ' ' GLU . 45.1 p -119.23 28.8 8.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.677 179.015 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -52.66 120.98 13.16 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.222 -0.899 . . . . 0.0 113.75 -178.862 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.3 t -140.63 130.68 24.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.727 0.299 . . . . 0.0 110.334 178.895 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.46 -134.71 22.9 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.54 -0.838 . . . . 0.0 111.994 -179.463 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -93.85 -12.29 29.28 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.813 0.34 . . . . 0.0 110.541 179.698 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.653 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.8 -41.17 66.98 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.738 179.454 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -60.48 -56.64 18.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.051 179.86 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -48.56 -23.13 0.89 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.66 179.774 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.571 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 41.8 t -78.19 -55.83 9.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.646 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.65 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -52.93 -41.31 64.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.167 0.508 . . . . 0.0 112.206 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.43 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 85.2 t -64.89 -60.03 3.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.74 -178.318 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -65.54 -47.86 74.44 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.612 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.527 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 67.6 t80 -60.13 -22.63 63.08 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.666 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 4.6 mt -59.48 -20.83 58.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.602 -179.718 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -73.1 -9.7 59.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.338 -179.785 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 69.3 p -127.99 23.67 6.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.204 -179.992 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 26.4 m80 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.998 179.724 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.478 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.166 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.644 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 14.0 t80 -63.43 -44.84 93.43 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.468 ' HG3' ' NH1' ' A' ' 53' ' ' ARG . 3.2 mt-10 -53.39 -54.18 48.12 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.158 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 98.9 Cg_exo -43.11 -18.18 0.11 Allowed 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.719 2.279 . . . . 0.0 113.09 -179.998 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.577 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.8 mt -80.06 -58.15 3.29 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.323 179.724 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.6 -16.24 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.854 179.291 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -69.16 -30.96 69.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.621 178.901 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.4 t -66.45 -16.76 64.36 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.147 179.462 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.8 mt -62.42 -6.78 3.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.131 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.3 m -120.26 23.42 10.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.455 -179.566 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.425 HD21 ' N ' ' A' ' 39' ' ' ARG . 52.0 p-10 -90.15 150.52 21.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.33 -179.749 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -65.88 -35.17 79.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.031 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -75.96 156.48 34.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.206 -179.624 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -106.49 -33.94 7.54 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.098 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.498 ' HG3' HG13 ' A' ' 38' ' ' ILE . 33.2 ptt180 -59.79 -40.18 87.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.045 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.498 HG13 ' HG3' ' A' ' 37' ' ' ARG . 60.0 mt -77.69 -37.63 24.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.8 179.865 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.503 HH12 HD11 ' A' ' 61' ' ' LEU . 2.1 tmt_? -58.44 -22.96 56.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.379 179.416 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -78.88 -50.17 6.07 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.336 179.775 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.38 -34.25 23.5 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.836 0.35 . . . . 0.0 110.81 179.695 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.496 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -60.99 -55.14 36.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.202 179.291 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.4 ' O ' HG22 ' A' ' 46' ' ' ILE . . . -64.19 -25.97 68.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.953 179.459 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.5 m95 -70.63 -37.43 73.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.234 -178.938 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 52.7 mt -99.17 -19.53 5.87 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-O 120.969 0.414 . . . . 0.0 111.755 -178.66 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.624 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.0 tt -56.82 -36.02 48.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.489 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.521 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -77.97 -22.15 69.45 Favored Glycine 0 CA--C 1.518 0.242 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.369 -178.996 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -70.75 2.14 4.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.352 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.444 ' HB3' ' OD2' ' A' ' 51' ' ' ASP . 36.8 m-85 -107.97 -25.42 11.18 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.788 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.581 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.9 mp0 63.76 39.64 8.33 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.12 0.486 . . . . 0.0 110.942 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.444 ' OD2' ' HB3' ' A' ' 49' ' ' PHE . 2.8 m-20 -100.8 169.51 8.95 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.532 -179.499 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.555 ' O ' HG22 ' A' ' 55' ' ' VAL . 8.7 pt-20 -66.48 -40.39 89.3 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.423 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.468 ' NH1' ' HG3' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -69.34 -8.7 48.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.658 0.266 . . . . 0.0 110.741 179.806 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.644 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -87.84 -35.99 17.47 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.584 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 52' ' ' GLU . 35.1 m -64.5 -39.57 86.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -178.003 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.653 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 3.6 tp10 -59.44 -54.2 58.37 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -178.641 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.653 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 80.1 Cg_exo -46.34 -52.11 7.76 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.297 1.998 . . . . 0.0 112.476 179.62 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.511 HD22 ' HA ' ' A' ' 73' ' ' ALA . 12.3 mt -53.65 -29.03 36.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.915 -179.14 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.0 mm -63.43 -60.73 2.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.43 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -70.1 -10.58 59.2 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -178.969 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.745 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.6 OUTLIER -83.02 -49.59 9.4 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.481 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.717 HD13 HD22 ' A' ' 92' ' ' LEU . 12.7 mt -56.39 -9.92 0.81 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.494 -179.311 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -123.78 -8.53 7.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.034 179.593 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.441 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 3.3 t70 -61.11 -38.83 87.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.074 0.464 . . . . 0.0 111.275 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.521 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 49.7 m-20 64.14 24.7 13.52 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.257 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.502 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.0 OUTLIER -83.91 7.64 17.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.291 -179.974 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.6 -78.32 0.73 Allowed Glycine 0 C--N 1.33 0.196 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.492 179.946 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -51.07 66.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.286 0.565 . . . . 0.0 109.969 179.422 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.745 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.8 t -62.63 -43.76 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.379 -179.8 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.521 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 37.8 ttp180 -66.77 -60.12 2.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.238 -179.686 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.0 m -51.51 -28.02 12.34 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.174 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -60.98 -46.01 95.44 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.184 179.702 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.511 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -66.96 -35.89 80.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.764 0.316 . . . . 0.0 111.085 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.17 -46.98 72.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.453 -179.691 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.413 ' HB2' ' NE2' ' A' ' 79' ' ' GLN . 7.8 ptp180 -78.88 -36.3 42.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.448 -179.688 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.521 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 58.8 m -59.37 -41.98 90.55 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.409 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.704 HD11 HD11 ' A' ' 62' ' ' LEU . 11.5 mt -61.1 -60.82 3.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.768 0.318 . . . . 0.0 110.718 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.451 ' HA ' ' CD1' ' A' ' 107' ' ' TYR . 34.0 mt-10 -53.77 -33.24 55.22 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.557 178.726 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.413 ' NE2' ' HB2' ' A' ' 75' ' ' ARG . 33.5 mt-30 -63.2 -42.48 99.33 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.853 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.581 HG23 ' HG3' ' A' ' 50' ' ' GLN . 91.7 mt -64.32 -60.39 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.21 179.117 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.59 133.32 0.05 OUTLIER Glycine 0 CA--C 1.518 0.251 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.881 179.782 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 133.39 164.36 10.76 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.586 179.822 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.4 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 12.7 pt-20 -65.19 -22.43 66.9 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.782 0.325 . . . . 0.0 110.738 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.638 ' HD3' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -60.57 -53.42 57.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 -179.998 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.638 ' N ' ' HD3' ' A' ' 84' ' ' ARG . 2.3 t -70.81 -26.14 27.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.053 0.454 . . . . 0.0 110.245 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.48 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 74.2 ttt180 -52.44 -31.9 36.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.756 -179.84 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.11 92.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.393 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.09 -35.94 78.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.219 179.34 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.668 ' HE1' HG12 ' A' ' 103' ' ' VAL . 8.2 mmm -67.8 -43.08 80.51 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.568 179.05 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 14.4 mm-40 -57.39 -36.4 71.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.724 178.494 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -75.89 -28.74 58.23 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.29 179.771 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.717 HD22 HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -87.16 -23.24 24.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.935 0.398 . . . . 0.0 110.428 179.817 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.15 -29.88 70.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.382 -179.843 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.516 ' HG3' HG23 ' A' ' 95' ' ' THR . 11.3 pt-20 -80.22 -23.23 41.04 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.975 0.417 . . . . 0.0 110.291 179.741 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.516 HG23 ' HG3' ' A' ' 94' ' ' GLU . 73.9 p -111.87 19.63 17.75 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.794 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.57 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -52.18 119.67 9.55 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 114.952 -1.022 . . . . 0.0 113.306 -179.201 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.3 t -144.1 130.35 19.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.813 0.339 . . . . 0.0 111.007 179.205 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.63 -131.01 50.74 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.902 179.936 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -77.36 -27.76 52.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.722 0.296 . . . . 0.0 111.278 -179.792 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.632 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.93 -31.42 50.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.68 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.57 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 47.8 ttt180 -75.31 -52.46 10.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.373 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -48.22 -22.0 0.59 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.268 0.556 . . . . 0.0 110.454 179.651 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.668 HG12 ' HE1' ' A' ' 89' ' ' MET . 49.1 t -69.05 -60.17 2.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.524 179.738 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.663 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.23 -46.97 84.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.179 0.514 . . . . 0.0 112.227 -179.596 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 59.5 t -64.88 -63.15 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -178.069 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -55.42 -37.3 67.48 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.199 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.585 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 22.9 t80 -61.5 -23.76 66.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.975 0.417 . . . . 0.0 111.421 -178.705 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 74.5 mt -58.1 -25.47 61.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.661 -179.478 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -85.38 0.45 52.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.522 -179.6 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 47.3 p -145.54 29.27 1.14 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -179.585 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.153 -0.927 . . . . 0.0 111.043 179.927 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.637 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.23 0.07 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 . . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.9 t80 -59.14 -56.21 25.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.698 -179.693 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.439 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.41 -51.26 69.08 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-O 119.216 -0.421 . . . . 0.0 111.724 179.979 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.637 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 59.8 Cg_exo -39.23 -29.65 0.22 Allowed 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 122.285 1.99 . . . . 0.0 111.254 179.174 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.9 mt -73.85 -55.18 6.52 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.726 -1.124 . . . . 0.0 109.339 177.882 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.52 HD22 HD12 ' A' ' 31' ' ' LEU . 3.0 tm? -53.33 -46.52 69.5 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.844 178.538 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -62.72 -41.87 99.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.738 179.931 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.558 ' HA ' ' HB2' ' A' ' 33' ' ' ASN . 47.4 t -66.37 -12.27 55.91 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.061 -179.278 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.52 HD12 HD22 ' A' ' 28' ' ' LEU . 49.0 mt -57.44 -24.3 54.78 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.915 0.388 . . . . 0.0 110.688 -179.774 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 71.3 p -125.8 21.81 7.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.628 179.723 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.558 ' HB2' ' HA ' ' A' ' 30' ' ' SER . 26.3 t-20 -57.36 141.22 47.86 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.074 -179.747 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.25 -43.51 96.07 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.731 -179.948 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -77.95 137.64 38.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.593 179.526 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 21.3 m95 -76.86 -29.79 56.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.146 -179.661 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -62.97 -45.29 93.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.875 179.902 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.6 mm -67.37 -36.06 75.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.766 179.771 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.609 HH12 HD21 ' A' ' 61' ' ' LEU . 1.3 tpm_? -64.9 -34.52 78.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.636 179.738 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.17 -64.46 2.99 Favored Glycine 0 C--N 1.33 0.204 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.751 -179.873 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.32 -33.91 9.68 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.732 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.576 ' HB3' HH21 ' A' ' 39' ' ' ARG . . . -63.64 -56.35 16.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.78 0.324 . . . . 0.0 110.782 179.967 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.27 -26.05 68.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.077 179.539 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.9 m95 -70.55 -39.72 73.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.526 -178.762 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.8 mt -98.88 -19.08 6.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.842 0.353 . . . . 0.0 111.868 -178.515 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.636 HD13 ' HG2' ' A' ' 57' ' ' PRO . 5.4 tt -53.9 -36.44 30.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.044 -178.996 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.27 -17.58 74.27 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.179 -179.551 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -70.33 -7.26 41.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.703 0.251 . . . . 0.0 111.58 -179.486 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -94.15 -24.92 17.34 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.598 0.237 . . . . 0.0 111.476 -179.905 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.654 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.7 mp0 60.74 30.28 19.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.382 179.485 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.46 ' O ' HG23 ' A' ' 55' ' ' VAL . 11.2 t70 -102.67 162.27 13.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.733 179.844 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -61.35 -36.23 79.63 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.011 -179.829 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.412 ' HG3' HD23 ' A' ' 28' ' ' LEU . 35.0 ttm180 -67.33 -9.61 42.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.026 0.441 . . . . 0.0 110.457 179.634 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.92 -7.99 21.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.558 -179.795 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.46 HG23 ' O ' ' A' ' 51' ' ' ASP . 21.4 t -90.22 -35.2 7.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.005 -179.769 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.525 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 20.6 tt0 -60.16 -48.44 94.31 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.341 -179.926 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.636 ' HG2' HD13 ' A' ' 46' ' ' ILE . 83.7 Cg_exo -46.18 -48.44 13.04 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 122.341 2.027 . . . . 0.0 112.094 179.365 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.451 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 1.7 mt -56.04 -33.06 64.62 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.8 -179.468 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 39.8 mm -57.16 -60.8 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.066 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -38.29 75.16 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.974 0.416 . . . . 0.0 111.826 -179.488 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.708 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.6 mp -57.08 -49.37 76.07 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -178.389 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.565 ' HB3' HD22 ' A' ' 92' ' ' LEU . 34.5 mt -60.44 -9.58 3.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.272 0.558 . . . . 0.0 110.008 -179.672 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -117.58 -12.0 10.39 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.843 179.511 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.522 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 6.5 t70 -61.05 -48.37 82.06 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.233 0.54 . . . . 0.0 111.152 -179.499 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.477 ' HB2' ' NH2' ' A' ' 70' ' ' ARG . 20.3 t70 68.98 21.39 7.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.806 179.447 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.48 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 36.2 m -86.22 12.14 10.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.265 -179.785 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.3 -100.78 1.42 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.614 179.712 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -46.27 -36.61 6.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.155 0.502 . . . . 0.0 110.512 179.762 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.708 HG12 ' HG ' ' A' ' 61' ' ' LEU . 16.4 t -73.57 -47.23 45.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.989 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.477 ' NH2' ' HB2' ' A' ' 65' ' ' ASP . 14.0 ttm180 -71.75 -61.76 1.66 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.651 0.263 . . . . 0.0 111.542 -179.48 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 87.6 p -50.56 -31.16 14.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.341 -179.706 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -62.66 -39.42 97.9 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.734 179.919 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.451 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -73.49 -30.03 62.89 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.599 0.238 . . . . 0.0 111.363 -179.983 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.8 -46.22 74.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.643 -179.591 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.1 ptp180 -79.28 -17.09 55.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.384 -179.716 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.0 t -63.82 -44.34 93.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.285 179.778 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.449 HD12 HD13 ' A' ' 58' ' ' LEU . 6.4 mp -58.95 -60.26 4.15 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.77 0.319 . . . . 0.0 111.138 179.997 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.402 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 3.7 tm-20 -50.92 -39.17 53.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.151 179.651 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -55.98 -38.37 70.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.339 -179.876 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.654 HG12 ' HG3' ' A' ' 50' ' ' GLN . 61.2 mt -86.95 -60.63 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.425 -179.767 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.82 93.81 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.512 -179.858 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.484 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 179.48 -174.16 45.96 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.779 -179.888 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -67.81 -31.93 72.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.891 0.376 . . . . 0.0 111.202 -179.7 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.549 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -60.44 -56.22 24.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.088 -179.814 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.549 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.6 OUTLIER -70.83 -20.69 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.839 0.352 . . . . 0.0 110.889 179.488 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.474 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 2.2 tmt_? -55.81 -31.98 63.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.801 179.404 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.421 ' O ' ' HG3' ' A' ' 90' ' ' GLU . . . -76.99 -23.94 52.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.865 179.801 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.24 -44.68 64.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.749 179.676 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.529 ' SD ' ' N ' ' A' ' 90' ' ' GLU . 2.3 ppp? -71.93 -30.58 65.48 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.276 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.529 ' N ' ' SD ' ' A' ' 89' ' ' MET . 1.0 OUTLIER -75.91 -29.19 58.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.936 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -72.05 -30.62 65.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.907 178.851 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.764 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.4 OUTLIER -87.33 -31.8 19.98 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.285 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.49 -24.98 61.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.408 178.807 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.21 -26.58 39.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.12 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 68.0 p -121.54 27.6 8.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.43 179.024 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -54.09 125.12 32.51 Favored Glycine 0 N--CA 1.448 -0.539 0 CA-C-N 115.086 -0.961 . . . . 0.0 113.683 -178.822 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.1 t -150.25 130.34 13.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.897 0.379 . . . . 0.0 111.033 179.129 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.22 -146.92 42.71 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.895 179.895 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.13 -28.71 62.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.672 0.272 . . . . 0.0 111.404 -179.805 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.679 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -55.25 -53.84 50.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.704 -179.79 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 39.4 ttp180 -55.24 -61.04 2.59 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.249 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 23.5 ttpp -45.67 -30.59 1.6 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.484 -179.174 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.535 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 4.8 t -65.06 -59.08 4.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.715 -179.82 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.764 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -51.39 -60.4 3.18 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.293 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 92.2 t -57.96 -61.24 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.447 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.401 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 12.0 m120 -55.49 -29.73 59.34 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.804 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.402 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 5.2 t80 -60.28 -33.07 71.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.135 0.493 . . . . 0.0 110.499 -179.899 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.433 HD21 ' SD ' ' A' ' 89' ' ' MET . 74.5 mt -55.24 -13.43 1.31 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.865 -179.419 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.504 ' HG3' HG23 ' A' ' 110' ' ' THR . 9.0 pt-20 -78.42 5.22 11.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.553 -179.998 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.504 HG23 ' HG3' ' A' ' 109' ' ' GLU . 70.0 p -144.98 7.06 1.19 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.436 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.824 -179.993 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.421 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 CA--C 1.523 -0.079 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.09 -52.95 62.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 110.316 179.449 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -63.37 -54.98 39.56 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.19 179.703 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 43.7 Cg_exo -51.74 -19.49 7.94 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.754 1.636 . . . . 0.0 110.758 179.733 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.662 HD21 ' HA ' ' A' ' 46' ' ' ILE . 1.4 tp -87.05 -36.06 18.39 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.416 179.809 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.64 HD12 HD12 ' A' ' 31' ' ' LEU . 21.1 tp -81.94 -22.48 36.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.338 -179.942 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.452 ' HG2' ' HA ' ' A' ' 26' ' ' PRO . 0.7 OUTLIER -74.91 -32.25 61.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.864 0.364 . . . . 0.0 110.998 -179.407 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 93.7 p -66.44 -20.05 65.95 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.41 -179.872 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.64 HD12 HD12 ' A' ' 28' ' ' LEU . 81.4 mt -66.19 -7.83 20.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.263 -179.824 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 98.2 p -106.91 21.82 16.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.826 179.769 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -84.7 142.99 29.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.08 -179.918 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -67.19 -17.53 64.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.597 179.746 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -86.36 156.63 20.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.659 179.835 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.9 p-90 -100.66 -34.29 9.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.427 -179.53 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -64.82 -44.74 88.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.774 0.321 . . . . 0.0 111.098 -179.901 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.4 mt -63.8 -42.92 97.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.717 -179.896 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -63.99 -21.63 66.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.553 179.765 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.12 -61.09 7.01 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.508 179.856 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.75 -34.77 28.49 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.737 0.303 . . . . 0.0 111.211 179.832 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.5 -56.72 18.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.709 179.729 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.37 -32.69 72.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.56 179.426 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.8 m95 -70.7 -29.33 65.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.466 -179.313 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.1 mt -99.02 -25.04 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-O 120.931 0.395 . . . . 0.0 111.574 -179.06 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.662 ' HA ' HD21 ' A' ' 27' ' ' LEU . 2.8 tt -60.55 -28.13 41.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.502 -178.792 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.569 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -66.23 -26.1 72.48 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.489 179.777 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -53.14 -39.65 63.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.398 . . . . 0.0 110.159 179.615 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -87.54 119.58 27.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.275 179.203 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.417 ' HG2' HG23 ' A' ' 80' ' ' ILE . 51.8 mt-30 -81.79 24.99 0.57 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.674 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -83.94 163.09 20.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.096 -179.8 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.45 -25.97 66.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.183 -179.805 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.436 ' HD3' HD22 ' A' ' 28' ' ' LEU . 18.7 ttm180 -68.12 -12.81 61.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.759 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.57 -4.47 21.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 -179.374 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.5 t -83.76 -40.09 15.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.916 -179.091 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 2.1 tm-20 -60.21 -49.61 89.93 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 -179.643 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.496 ' HG2' HD13 ' A' ' 46' ' ' ILE . 92.8 Cg_exo -43.72 -52.3 5.45 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 122.244 1.963 . . . . 0.0 112.083 179.229 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 24.5 mt -49.82 -37.14 29.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.394 -0.821 . . . . 0.0 112.197 -179.81 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 44.7 mm -61.0 -62.09 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.07 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.423 ' HG3' HD13 ' A' ' 61' ' ' LEU . 5.3 pttt -72.71 -6.58 45.5 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.934 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.705 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -89.03 -46.45 8.85 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -178.322 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.801 HD13 HD22 ' A' ' 92' ' ' LEU . 10.0 mt -60.76 -10.01 4.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.14 0.495 . . . . 0.0 110.377 -179.277 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -115.46 -14.98 11.54 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.146 -179.655 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -61.13 -31.59 71.3 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.124 0.488 . . . . 0.0 111.284 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.495 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 55.6 m-20 51.58 28.08 4.4 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.039 179.912 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 33.0 t -86.33 7.13 26.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.683 0.278 . . . . 0.0 111.27 179.903 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.59 -96.02 1.73 Allowed Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.296 -179.89 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -50.33 -43.63 54.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.128 0.49 . . . . 0.0 110.15 179.524 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.705 HG12 ' HG ' ' A' ' 61' ' ' LEU . 11.8 t -73.62 -46.23 48.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.864 -179.806 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.495 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 4.3 tmm_? -66.09 -64.03 0.95 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.549 -179.091 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.9 m -54.39 -27.1 34.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.608 179.827 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.6 -46.46 88.57 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.64 -0.79 . . . . 0.0 111.936 179.57 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' ' 77' ' ' LEU . . . -59.19 -56.09 26.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.581 0.229 . . . . 0.0 111.14 179.774 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -51.79 -27.0 10.87 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.07 0.462 . . . . 0.0 110.883 -179.562 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 34.8 ttt85 -80.31 -40.04 27.54 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.916 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.569 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 0.0 OUTLIER -67.08 -35.24 79.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.2 -178.966 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.474 HD12 ' O ' ' A' ' 73' ' ' ALA . 3.5 mp -56.68 -59.06 5.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.654 0.264 . . . . 0.0 111.092 -179.663 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.442 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 44.7 mt-10 -49.0 -27.15 2.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.804 179.817 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -70.73 -43.61 68.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.779 0.323 . . . . 0.0 111.501 -179.86 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.417 HG23 ' HG2' ' A' ' 50' ' ' GLN . 46.7 mt -70.06 -61.28 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.8 -179.12 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 53.14 89.52 0.01 OUTLIER Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.498 -179.716 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.448 ' H ' ' CG1' ' A' ' 85' ' ' VAL . . . 178.33 -173.45 45.88 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.607 -179.623 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.436 ' O ' ' HB2' ' A' ' 86' ' ' ARG . 4.9 tm-20 -72.24 -25.8 61.77 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.781 0.324 . . . . 0.0 111.181 -179.691 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.551 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -70.0 -50.72 38.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.984 0.421 . . . . 0.0 110.499 179.839 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.551 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 11.5 p -70.66 -25.69 26.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.434 179.132 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.593 ' NH2' ' HA ' ' A' ' 108' ' ' LEU . 1.1 mmp_? -47.12 -40.08 14.74 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.152 179.635 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.11 -30.92 71.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.443 -179.389 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.36 -55.42 33.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.81 -179.796 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.492 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.3 -25.86 65.35 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.198 -179.389 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 42.5 mt-10 -73.02 -34.37 66.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.97 0.414 . . . . 0.0 109.995 179.133 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -78.92 -24.9 43.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.427 179.111 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.801 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -87.63 -30.19 20.64 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.203 179.323 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.27 -29.97 67.96 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.147 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.07 -26.57 39.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.15 0.5 . . . . 0.0 109.692 179.339 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.8 p -107.59 21.24 17.75 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.608 178.524 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.617 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -46.48 108.53 0.27 Allowed Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.124 -0.943 . . . . 0.0 112.751 -179.431 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.441 ' O ' ' HB3' ' A' ' 100' ' ' ALA . 33.1 p -139.75 129.36 24.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.732 0.301 . . . . 0.0 110.727 -179.882 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 55.38 -145.02 32.11 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.858 -179.879 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -58.92 -30.46 67.86 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.715 0.293 . . . . 0.0 111.161 179.975 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.631 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -52.19 -42.59 63.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.852 -179.615 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.617 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 43.2 ttt180 -66.5 -55.6 14.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.676 0.274 . . . . 0.0 111.623 -179.535 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.2 tptp -46.05 -25.13 0.52 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.593 179.915 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.519 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 21.3 t -71.83 -58.43 5.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.912 -179.868 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.541 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -51.35 -60.88 2.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.819 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.522 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 21.8 t -56.58 -47.9 81.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -178.04 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -71.01 -35.01 71.89 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -179.52 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.514 ' OH ' HG11 ' A' ' 85' ' ' VAL . 14.1 t80 -64.11 -46.96 81.91 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.292 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.593 ' HA ' ' NH2' ' A' ' 86' ' ' ARG . 3.0 pp -55.34 -10.85 0.66 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.187 -178.882 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -89.11 6.96 37.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.52 0.2 . . . . 0.0 111.467 179.735 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.5 p -129.81 -66.54 0.79 Allowed 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.792 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.521 ' HB3' HH22 ' A' ' 86' ' ' ARG . 21.4 p80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 117.949 -1.024 . . . . 0.0 111.331 -179.266 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.945 0.402 . . . . 0.0 110.795 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.638 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.4 t80 -63.53 -45.28 91.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.444 179.95 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.446 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 24.2 mt-10 -63.37 -55.63 33.97 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.018 -179.653 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 9.4 Cg_endo -54.93 -16.1 11.2 Favored 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 121.74 1.626 . . . . 0.0 110.704 179.344 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.44 ' HB3' ' O ' ' A' ' 24' ' ' PHE . 1.0 OUTLIER -85.62 -34.31 21.43 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.461 -1.245 . . . . 0.0 108.881 178.842 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.491 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -77.32 -39.26 48.4 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.988 178.869 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -64.52 -37.14 86.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.214 -179.308 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 89.4 p -66.33 -14.56 62.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.945 -179.172 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.45 HD12 HD13 ' A' ' 28' ' ' LEU . 96.5 mt -60.15 -29.15 68.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.747 0.308 . . . . 0.0 111.154 -179.893 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.9 m -92.46 20.88 5.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.667 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.622 ' ND2' ' HB ' ' A' ' 38' ' ' ILE . 20.3 p-10 -75.3 150.56 38.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.851 179.995 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -67.05 -20.7 65.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.304 -179.807 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.568 ' HB2' ' ND2' ' A' ' 33' ' ' ASN . 7.5 m-20 -78.65 162.98 25.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.893 0.378 . . . . 0.0 111.052 -179.821 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -104.57 -44.43 4.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.829 -179.7 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.506 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 71.4 mtp85 -58.83 -58.36 8.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.663 -179.703 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.622 ' HB ' ' ND2' ' A' ' 33' ' ' ASN . 71.1 mt -50.05 -40.6 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.496 -179.582 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.467 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 43.1 ttp180 -64.41 -40.22 95.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.012 179.896 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -59.8 -58.86 12.0 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.285 179.952 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.66 -28.81 6.34 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.683 0.278 . . . . 0.0 111.173 179.675 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 39' ' ' ARG . . . -59.24 -56.37 23.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.721 179.702 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.61 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -64.24 -32.47 74.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.611 179.445 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.418 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 12.6 m95 -55.72 -32.02 62.98 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.959 179.926 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 50.9 mm -98.51 -24.52 4.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.61 179.507 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.61 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 5.6 mm -55.43 -44.59 76.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.654 -179.979 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.34 -22.75 59.15 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.796 -0.716 . . . . 0.0 113.214 -179.397 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -68.42 -40.55 81.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.81 0.305 . . . . 0.0 111.445 -179.797 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -97.15 112.22 24.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.718 0.294 . . . . 0.0 110.452 -179.929 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -77.22 58.14 1.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.767 179.762 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -102.7 172.69 6.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.935 -179.526 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -66.25 -45.47 80.44 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.876 -179.307 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -6.92 13.26 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.244 -0.183 . . . . 0.0 111.118 179.893 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.638 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -95.65 8.92 42.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.011 0.434 . . . . 0.0 111.042 -178.752 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 45.4 t -92.01 -59.11 3.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.558 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.415 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 27.3 tt0 -60.29 -49.64 89.63 Favored Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.495 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.47 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 58.4 Cg_exo -38.23 -44.88 2.06 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.709 2.273 . . . . 0.0 113.391 -179.088 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.609 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 8.0 mt -62.55 -54.05 45.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.321 -179.369 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.416 ' HA ' HD12 ' A' ' 62' ' ' LEU . 83.1 mt -50.53 -53.95 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.048 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.426 ' H ' ' HG3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -70.16 -24.27 63.13 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -177.956 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.586 ' HG ' HG12 ' A' ' 69' ' ' VAL . 3.7 tp -90.13 -20.0 23.63 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -178.716 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.668 HD13 HD11 ' A' ' 92' ' ' LEU . 6.3 mt -69.5 -12.59 61.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.937 0.399 . . . . 0.0 110.635 -179.916 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -112.68 1.73 15.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.978 -179.893 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -61.15 -30.35 70.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.165 0.507 . . . . 0.0 110.642 179.759 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.544 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 26.3 m-20 48.63 27.6 1.54 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.135 -0.939 . . . . 0.0 112.279 179.628 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.49 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 38.6 t -86.32 -15.06 41.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.765 0.316 . . . . 0.0 110.677 179.808 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 118.0 -109.94 1.9 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.504 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.506 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -59.15 -25.42 63.87 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.659 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.586 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.4 t -71.18 -32.29 47.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.645 178.61 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.544 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 52.8 ttp180 -78.7 -44.39 23.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.698 179.422 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.457 ' HA ' ' HZ ' ' A' ' 99' ' ' PHE . 28.9 t -67.09 -41.73 85.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.452 -179.83 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -51.18 -45.83 51.6 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.417 -179.79 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.609 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -71.75 -31.79 67.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.649 0.262 . . . . 0.0 111.048 179.68 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.636 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -60.17 -54.22 48.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.755 -179.224 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -61.88 -27.5 68.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.328 -179.645 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.443 ' HB2' HD22 ' A' ' 58' ' ' LEU . 50.4 m -58.87 -33.98 71.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.127 -179.831 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.611 HD11 HD11 ' A' ' 62' ' ' LEU . 9.1 mp -61.25 -60.64 3.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.89 0.376 . . . . 0.0 110.441 179.455 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -55.84 -24.95 39.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.295 178.909 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 76' ' ' SER . 42.6 mt-30 -70.73 -50.91 31.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.741 179.767 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.544 ' HB ' HG21 ' A' ' 85' ' ' VAL . 74.3 mt -66.03 -60.79 2.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.057 -179.984 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.64 127.46 0.02 OUTLIER Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.621 179.913 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 145.06 178.04 20.33 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.848 179.775 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.53 -34.35 78.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.846 0.355 . . . . 0.0 110.714 -179.99 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.51 ' CD ' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.72 -47.82 81.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.942 -179.881 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.544 HG21 ' HB ' ' A' ' 80' ' ' ILE . 33.1 t -70.56 -26.33 28.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.419 . . . . 0.0 110.648 179.654 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -58.61 -23.13 58.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.671 -179.895 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.9 -27.97 26.26 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.193 0.52 . . . . 0.0 109.771 179.434 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.98 -40.03 83.2 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.213 179.049 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.723 ' HE1' HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.2 -36.96 74.95 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.656 179.181 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -57.86 -32.72 67.94 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.623 178.876 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.8 tmtm? -64.56 -52.65 56.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.736 179.57 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.668 HD11 HD13 ' A' ' 62' ' ' LEU . 54.4 mt -61.83 -37.59 85.01 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.717 0.294 . . . . 0.0 110.712 -179.915 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.414 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -54.58 -31.03 56.06 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.179 0.514 . . . . 0.0 110.282 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -86.66 -21.93 26.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.013 179.425 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.2 p -118.01 38.15 3.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.122 -179.869 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.417 ' HA2' ' HB2' ' A' ' 101' ' ' ARG . . . -39.4 109.36 0.11 Allowed Glycine 0 C--N 1.334 0.448 0 CA-C-N 116.092 -0.504 . . . . 0.0 113.198 -179.78 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.1 t -151.88 138.55 18.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.834 0.349 . . . . 0.0 111.459 -179.888 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 55.09 -139.24 41.35 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.81 179.673 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.457 ' HZ ' ' HA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -94.76 -13.97 25.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.843 0.354 . . . . 0.0 110.6 -179.903 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.426 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -56.37 -35.02 67.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.829 179.824 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.417 ' HB2' ' HA2' ' A' ' 96' ' ' GLY . 11.0 tpt180 -61.74 -60.27 3.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.335 179.486 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -51.55 -32.62 28.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.022 179.277 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.426 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 22.7 t -64.57 -46.87 91.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.97 179.484 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.549 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -61.49 -51.92 66.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.977 -179.562 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 59.9 t -63.62 -60.9 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.273 -179.022 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -57.26 -30.08 64.36 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.744 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.03 -29.44 67.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.165 0.507 . . . . 0.0 110.039 -179.892 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.723 HD11 ' HE1' ' A' ' 89' ' ' MET . 98.0 mt -55.61 -25.29 37.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.011 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -51.26 -34.97 35.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.9 p -95.99 -57.0 2.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.329 179.994 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.959 179.993 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.408 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.231 0.117 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 . . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.472 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.3 t80 -60.93 -48.01 83.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.24 -179.917 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.411 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.49 -55.26 36.61 Favored Pre-proline 0 C--N 1.33 -0.249 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.238 179.775 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.411 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 52.5 Cg_exo -49.73 -26.34 13.12 Favored 'Trans proline' 0 C--N 1.357 1.019 0 C-N-CA 121.726 1.617 . . . . 0.0 110.458 179.022 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.52 HD11 HD12 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -76.93 -42.51 39.08 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.554 179.186 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 31' ' ' LEU . 11.7 tp -76.16 -17.15 59.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.04 178.937 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -74.53 -32.16 62.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.744 -179.79 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.482 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 71.6 m -66.41 -22.48 66.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.235 -179.779 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.684 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 93.6 mt -67.01 -9.54 40.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.81 0.338 . . . . 0.0 110.851 179.942 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.4 t -112.42 19.57 17.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.8 179.853 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.482 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 77.0 m-20 -89.82 147.53 23.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.212 -179.974 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -66.23 -23.05 66.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.772 179.835 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -78.01 149.18 34.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.935 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.6 p90 -93.28 -38.45 11.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.861 180.0 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.433 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 72.9 mtt-85 -60.4 -54.08 49.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.314 179.693 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.3 mm -54.57 -40.88 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.589 -179.359 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.684 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 39.7 ttm180 -65.46 -27.34 68.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.381 -179.774 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.533 ' HA2' HG13 ' A' ' 69' ' ' VAL . . . -64.4 -63.0 4.61 Favored Glycine 0 N--CA 1.453 -0.183 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.546 -179.782 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.57 -22.69 0.3 Allowed 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 179.995 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.431 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.5 -57.31 13.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.727 0.298 . . . . 0.0 110.924 179.85 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.97 -24.89 66.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.922 0.392 . . . . 0.0 110.805 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -61.85 -39.2 91.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.394 -179.925 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 33.5 mm -100.93 -21.62 5.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-O 120.831 0.348 . . . . 0.0 111.8 -179.521 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.52 HD12 HD11 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -54.52 -38.01 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.265 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.3 -20.6 79.6 Favored Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 120.507 -0.854 . . . . 0.0 113.205 -178.979 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.8 -0.8 9.77 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.383 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.432 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 91.0 m-85 -103.68 -34.01 8.76 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.716 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 49' ' ' PHE . 53.7 mt-30 67.31 57.27 0.59 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.245 0.545 . . . . 0.0 110.976 179.9 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -128.26 164.72 21.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.041 -179.803 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -65.48 -32.48 74.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.149 0.5 . . . . 0.0 110.098 179.355 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -69.3 -9.65 54.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.806 179.81 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.494 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -104.68 2.16 30.18 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.997 -179.378 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.2 t -86.57 -47.72 16.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.444 -179.416 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.492 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 23.2 tt0 -60.35 -47.76 95.67 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.788 -179.838 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 98.7 Cg_exo -43.68 -42.7 11.56 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.589 2.193 . . . . 0.0 113.002 -179.622 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.618 HD13 HD12 ' A' ' 77' ' ' LEU . 11.3 mt -64.66 -39.79 94.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.057 -179.874 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.423 HD11 ' HB1' ' A' ' 88' ' ' ALA . 47.6 mm -54.57 -57.66 5.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.981 -179.564 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.2 tmmm? -70.07 -28.46 65.45 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -178.353 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.538 ' HB3' ' HB2' ' A' ' 73' ' ' ALA . 4.7 tp -89.62 -21.39 22.83 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -177.521 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.749 HD13 HD22 ' A' ' 92' ' ' LEU . 22.4 mt -67.19 -20.81 65.77 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.584 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -92.41 -11.38 35.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.676 178.764 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.412 ' OD2' ' HB ' ' A' ' 69' ' ' VAL . 11.9 t70 -52.27 145.76 10.38 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.883 -178.523 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -118.29 27.0 9.23 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.021 -179.836 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.537 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 27.0 t -86.44 -36.38 19.13 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.898 -179.903 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 126.76 -96.72 0.47 Allowed Glycine 0 N--CA 1.452 -0.263 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.921 -179.603 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.433 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -61.48 -26.97 68.25 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.104 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.537 ' HB ' ' HB3' ' A' ' 66' ' ' SER . 32.2 t -67.95 -36.48 75.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.106 178.999 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -74.04 -55.3 6.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.358 179.549 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 36.8 t -59.07 -25.76 64.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.929 179.833 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.59 -45.6 89.87 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.367 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.538 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . . . -70.04 -30.28 67.52 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.863 0.363 . . . . 0.0 110.674 179.664 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 77' ' ' LEU . . . -61.75 -53.04 61.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.897 -179.439 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -66.22 -22.53 66.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.682 -179.152 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.446 ' O ' HG13 ' A' ' 80' ' ' ILE . 40.4 t -58.59 -32.84 69.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.488 -179.645 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.618 HD12 HD13 ' A' ' 58' ' ' LEU . 7.2 mp -55.38 -62.27 1.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.503 -179.82 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.461 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 42.2 mt-10 -55.42 -32.84 63.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.255 179.563 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -70.7 -27.17 63.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.165 -179.961 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 76' ' ' SER . 96.7 mt -83.16 -59.02 3.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.769 -179.284 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.645 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . -179.56 -116.37 0.51 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.034 -1.079 . . . . 0.0 113.411 -179.516 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.454 ' O ' ' HB2' ' A' ' 86' ' ' ARG . . . -157.91 -71.02 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 121.208 -0.52 . . . . 0.0 112.022 -179.972 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.419 ' HG3' ' NH2' ' A' ' 86' ' ' ARG . 43.1 tt0 -72.24 -21.83 61.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.864 0.364 . . . . 0.0 111.244 -179.922 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.645 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.0 OUTLIER -75.58 -56.97 4.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.206 -178.912 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' ' SD ' ' A' ' 89' ' ' MET . 0.4 OUTLIER -68.3 -29.94 46.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.413 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 33.1 ttp180 -41.83 -35.05 0.74 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.921 -179.401 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.83 -49.37 75.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.872 0.368 . . . . 0.0 110.764 -179.877 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.423 ' HB1' HD11 ' A' ' 59' ' ' ILE . . . -69.44 -34.54 74.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.859 179.588 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.617 ' HG3' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -60.64 -48.45 81.71 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.18 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 46.7 mt-10 -56.13 -35.6 67.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.425 178.051 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -76.54 -25.86 54.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.979 179.753 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.813 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.9 OUTLIER -84.46 -24.98 29.26 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.774 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.71 -28.05 68.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.894 178.904 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -80.24 -25.66 39.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.258 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.8 p -109.42 17.18 21.72 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.433 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.534 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -54.49 116.82 6.89 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 114.7 -1.136 . . . . 0.0 113.311 -179.079 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.3 t -142.41 132.14 24.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.861 0.362 . . . . 0.0 110.958 179.258 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.26 -124.72 35.51 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.559 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.574 ' O ' HG23 ' A' ' 103' ' ' VAL . 68.5 t80 -79.91 -29.99 39.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.881 0.372 . . . . 0.0 110.37 179.583 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.587 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.79 -36.11 35.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.483 179.837 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.534 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 23.4 ttt180 -70.4 -61.11 1.9 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.655 -179.535 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -47.8 -22.27 0.52 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.238 -179.492 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 99' ' ' PHE . 39.2 t -63.53 -60.27 3.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.792 -179.916 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.813 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.99 -62.35 1.88 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.224 0.535 . . . . 0.0 112.431 -179.203 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.537 HG13 ' H ' ' A' ' 106' ' ' ASN . 3.1 p -52.68 -56.81 5.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.227 -0.897 . . . . 0.0 113.267 -178.294 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.537 ' H ' HG13 ' A' ' 105' ' ' VAL . 55.1 t30 -59.97 -35.38 74.87 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -178.813 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.582 ' HD2' ' HG2' ' A' ' 89' ' ' MET . 30.2 t80 -61.8 -25.48 67.52 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.98 0.419 . . . . 0.0 110.688 -179.323 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 99.3 mt -58.95 -13.18 5.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.592 179.694 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -64.98 -7.24 10.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.604 179.84 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 73.0 p -93.12 -49.82 5.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.648 179.64 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.884 179.486 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.531 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.182 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 . . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.474 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.9 t80 -57.99 -52.38 65.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.717 -179.028 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.46 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 2.8 mt-10 -62.63 -57.17 23.63 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.674 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 13.9 Cg_endo -57.41 -12.03 9.82 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 122.112 1.875 . . . . 0.0 111.892 -179.729 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.636 HD21 ' HA ' ' A' ' 46' ' ' ILE . 1.9 tp -84.89 -44.3 13.31 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.96 179.899 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.438 ' H ' ' HG ' ' A' ' 28' ' ' LEU . 3.1 pp -84.34 -16.34 43.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.693 178.733 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -71.76 -31.38 66.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.086 179.566 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 t -66.35 -19.09 65.71 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.122 179.986 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 57' ' ' PRO . 91.5 mt -57.14 -16.77 8.49 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.856 0.36 . . . . 0.0 111.03 -179.926 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 74.6 m -94.7 23.46 5.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.224 -179.94 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.553 HD21 ' HB2' ' A' ' 39' ' ' ARG . 2.2 p30 -85.37 147.48 26.49 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.819 0.342 . . . . 0.0 110.583 -179.728 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -66.95 -25.89 66.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.143 -178.885 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -82.72 163.54 21.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.35 . . . . 0.0 111.082 -179.798 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.7 p-90 -101.75 -35.68 8.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.141 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.512 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 67.9 ttt180 -62.78 -29.74 70.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.35 -179.78 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.1 mt -76.5 -48.98 25.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.785 0.326 . . . . 0.0 111.256 -179.793 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.553 ' HB2' HD21 ' A' ' 33' ' ' ASN . 31.5 ttm180 -55.69 -27.83 52.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.254 -179.715 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.689 ' HA2' HD21 ' A' ' 61' ' ' LEU . . . -67.68 -55.68 13.78 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.744 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.13 -29.67 14.18 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.774 0.321 . . . . 0.0 111.245 179.793 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.564 ' O ' HD11 ' A' ' 27' ' ' LEU . . . -57.73 -54.37 47.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.851 179.797 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.542 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -68.43 -29.3 67.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.008 179.943 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.419 ' CD1' ' HA3' ' A' ' 72' ' ' GLY . 6.6 m95 -59.94 -38.04 81.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.626 -179.899 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.1 mm -98.87 -19.49 5.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.837 0.351 . . . . 0.0 111.718 -179.776 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.672 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.2 OUTLIER -52.74 -44.03 46.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.009 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.97 -13.51 83.09 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.69 -0.767 . . . . 0.0 113.701 -178.748 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -70.77 -3.5 19.11 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 -179.37 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -99.59 -30.4 12.15 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.27 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.467 ' HG3' HG13 ' A' ' 80' ' ' ILE . 1.1 tt0 71.0 51.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.135 0.493 . . . . 0.0 111.029 179.284 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -127.45 155.71 43.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.13 -179.97 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.576 ' O ' HG22 ' A' ' 55' ' ' VAL . 0.4 OUTLIER -63.51 -30.3 71.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.664 179.734 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -69.22 -10.11 56.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.96 179.738 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.672 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -94.54 11.96 29.08 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -179.032 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.576 HG22 ' O ' ' A' ' 52' ' ' GLU . 23.0 m -91.68 -42.15 13.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.359 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.592 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 6.5 tp10 -60.34 -50.31 86.42 Favored Pre-proline 0 C--N 1.327 -0.378 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.667 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.676 ' HB3' HD11 ' A' ' 31' ' ' LEU . 52.3 Cg_exo -53.67 -23.54 26.46 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.262 1.975 . . . . 0.0 112.88 -179.271 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.546 HD22 ' HA ' ' A' ' 73' ' ' ALA . 57.2 mt -84.99 -40.69 16.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.09 -179.58 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.607 ' HA ' HD12 ' A' ' 62' ' ' LEU . 49.9 mm -58.88 -43.33 88.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.837 -179.536 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -70.03 -26.65 64.14 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -178.821 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.689 HD21 ' HA2' ' A' ' 40' ' ' GLY . 5.2 tp -88.97 -29.07 19.81 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -178.21 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.639 HD13 HD22 ' A' ' 92' ' ' LEU . 15.5 mt -58.66 -19.16 36.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.975 0.417 . . . . 0.0 110.565 179.153 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -111.93 -0.93 15.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.162 -179.882 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.541 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 6.2 t70 -61.25 -36.95 81.38 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.408 0.623 . . . . 0.0 110.482 -179.849 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.459 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 10.8 m-20 56.7 25.67 10.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.522 179.296 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.456 ' HB2' ' OD1' ' A' ' 64' ' ' ASP . 0.3 OUTLIER -80.5 -27.75 37.66 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 121.057 0.456 . . . . 0.0 109.959 179.262 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 131.9 -103.64 0.54 Allowed Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.554 179.709 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.512 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -58.34 -24.31 59.37 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 117.041 0.42 . . . . 0.0 109.949 179.855 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.408 HG12 ' HA3' ' A' ' 40' ' ' GLY . 4.0 m -70.24 -40.19 77.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 121.231 0.539 . . . . 0.0 109.774 178.495 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.459 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 50.5 ttp180 -71.12 -44.96 64.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.542 179.921 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.4 p -67.16 -35.08 78.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.87 179.469 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.492 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -62.22 -55.8 25.74 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.647 -179.736 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.546 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -58.08 -39.5 78.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.899 0.381 . . . . 0.0 110.714 179.749 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.458 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.89 -46.07 90.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.512 -179.76 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 0.2 OUTLIER -70.85 -32.64 69.73 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.423 -179.041 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' A' ' 79' ' ' GLN . 46.5 m -61.79 -34.44 75.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.806 0.336 . . . . 0.0 110.996 -179.791 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.6 HD11 HD11 ' A' ' 62' ' ' LEU . 66.5 mt -59.64 -60.65 3.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.977 0.418 . . . . 0.0 110.62 179.576 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -65.34 -18.18 65.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.641 179.456 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.437 ' HB3' ' O ' ' A' ' 76' ' ' SER . 48.4 tt0 -56.88 -39.93 75.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.91 -179.897 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.506 HG21 ' HD2' ' A' ' 84' ' ' ARG . 3.2 mp -80.43 -56.77 5.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.928 179.584 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.454 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 71.03 58.56 5.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.339 -179.781 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -135.13 179.84 17.27 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.304 179.786 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.08 -22.1 64.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.809 0.338 . . . . 0.0 110.836 179.957 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.513 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -76.9 -31.42 56.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.786 -179.271 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.513 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 38.2 t -70.31 -33.76 55.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.915 0.388 . . . . 0.0 110.195 179.412 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.8 ttp180 -56.26 -21.93 26.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.062 179.961 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.33 -33.86 37.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.688 179.928 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.18 -31.03 68.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.971 179.805 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.509 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 10.0 mmm -72.21 -50.03 30.67 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.306 179.866 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.43 -35.62 65.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.168 179.4 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.463 ' O ' ' HD3' ' A' ' 91' ' ' LYS . 11.7 tmtt? -70.27 -31.73 69.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.866 179.853 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.639 HD22 HD13 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -85.99 -28.62 24.09 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 179.845 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.46 -28.91 60.94 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.849 178.83 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -80.18 -27.76 38.86 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.077 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.3 p -109.35 25.96 11.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.68 178.827 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.488 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -49.75 113.06 1.64 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.45 -178.983 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 58.2 m -141.1 130.4 23.63 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.181 -0.304 . . . . 0.0 110.181 179.435 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.26 -130.27 12.23 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.063 -179.381 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -95.82 -15.82 22.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.732 0.301 . . . . 0.0 110.839 179.939 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.464 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.71 -42.89 62.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.437 -179.749 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.488 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 60.5 ttt180 -59.29 -60.7 3.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.01 -179.969 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.6 tttp -49.91 -24.33 2.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.25 0.548 . . . . 0.0 110.333 179.621 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.46 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.1 t -79.82 -48.56 20.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.388 179.943 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.588 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.62 -53.08 62.35 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.258 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 28.3 t -64.91 -58.99 4.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.917 -178.084 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -55.59 -38.61 69.63 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.519 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.509 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 36.7 t80 -63.34 -25.22 68.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.829 0.347 . . . . 0.0 111.231 -178.805 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 94.0 mt -56.37 -20.13 17.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.543 -179.785 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -78.56 6.23 9.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.603 -179.416 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.0 p -138.9 -53.46 0.58 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.469 179.917 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.8 p-80 . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.43 -179.788 . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.654 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 CA--C 1.522 -0.123 0 CA-C-O 120.773 0.32 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.513 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 1.9 t80 -56.49 -64.82 0.74 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.725 179.798 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.522 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.36 -50.8 72.4 Favored Pre-proline 0 C--N 1.329 -0.314 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 179.563 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.654 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 53.9 Cg_exo -45.81 -25.06 2.36 Favored 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 121.933 1.756 . . . . 0.0 110.826 179.706 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.689 HD21 HG13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -82.62 -47.08 12.49 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.364 178.921 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 28' ' ' LEU . 1.0 OUTLIER -58.26 -39.33 78.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.13 178.443 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -59.81 -29.07 67.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.393 -179.21 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.9 m -64.98 -22.43 67.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.581 -179.356 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.466 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 68.0 mt -69.55 -11.74 61.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.054 -179.844 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.3 t -109.65 13.09 23.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.705 179.889 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -78.55 135.68 37.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.031 -179.862 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -58.22 -26.84 63.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.207 -179.986 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -84.84 130.85 34.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.046 179.993 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -84.04 -27.74 28.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.729 179.809 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.8 mtp180 -62.51 -42.11 99.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.585 179.537 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.4 mt -79.89 -31.57 13.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.768 179.952 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.466 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 35.6 ttm180 -65.53 -36.21 83.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.626 179.732 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -57.34 -48.81 77.67 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.072 179.818 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.31 -35.86 68.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.7 0.285 . . . . 0.0 110.944 179.611 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.417 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.7 -53.2 59.5 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.424 179.514 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.37 90.8 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.454 179.126 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.677 ' HA ' ' NH1' ' A' ' 75' ' ' ARG . 7.9 m95 -63.62 -28.55 70.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.013 -179.233 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.7 mm -98.95 -24.07 4.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.921 0.391 . . . . 0.0 111.108 179.839 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.689 HG13 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -60.84 -30.97 48.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.847 -179.315 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.514 ' HA3' HH21 ' A' ' 75' ' ' ARG . . . -61.26 -28.99 70.12 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.86 -179.744 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -59.84 -26.2 65.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.85 0.357 . . . . 0.0 110.399 179.857 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.404 ' C ' ' H ' ' A' ' 51' ' ' ASP . 47.0 m-85 -94.94 111.72 23.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.486 179.847 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -80.27 36.72 0.37 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.461 179.831 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.473 ' O ' HG23 ' A' ' 55' ' ' VAL . 20.6 m-20 -102.34 158.18 16.38 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.789 -179.698 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.72 -33.75 75.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.798 -179.189 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.513 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 18.8 ttm180 -65.84 -13.44 59.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.951 0.405 . . . . 0.0 110.558 -180.0 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.427 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -105.15 -3.03 23.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.353 179.97 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 51' ' ' ASP . 93.2 t -91.21 -34.26 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.277 -179.907 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.465 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 20.9 tt0 -60.36 -44.85 97.06 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 116.272 -0.422 . . . . 0.0 112.077 -179.864 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.554 ' O ' HD13 ' A' ' 61' ' ' LEU . 94.6 Cg_exo -45.53 -53.0 6.0 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.437 2.091 . . . . 0.0 113.578 -179.548 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.756 HD12 ' HA ' ' A' ' 73' ' ' ALA . 0.1 OUTLIER -54.27 -30.32 50.2 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.965 0.358 . . . . 0.0 111.965 -178.864 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 43.5 mm -55.12 -59.06 2.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.736 0.303 . . . . 0.0 111.584 -179.557 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -70.06 -37.16 75.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.802 -179.518 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.714 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -52.54 -55.55 21.38 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.91 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.666 HD13 HD22 ' A' ' 92' ' ' LEU . 9.3 mt -51.76 -13.92 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.609 -179.729 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -113.11 -19.15 11.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.024 179.857 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.443 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 7.9 t0 -61.18 -34.56 75.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.005 0.431 . . . . 0.0 111.422 -179.773 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.658 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 14.4 m-20 54.85 29.64 12.36 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.317 -179.707 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.507 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.0 t -83.18 0.29 46.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.383 -179.973 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.61 -78.19 1.67 Allowed Glycine 0 C--O 1.228 -0.237 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.199 -179.665 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.95 -45.2 94.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.158 0.504 . . . . 0.0 109.818 179.32 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.714 HG12 ' HG ' ' A' ' 61' ' ' LEU . 10.7 t -73.63 -46.68 47.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.514 -179.839 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.658 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 14.0 ttp180 -63.35 -59.23 4.97 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -179.357 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.4 t -50.91 -32.78 21.74 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.98 -179.353 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.56 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -54.24 -47.66 67.11 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.817 179.479 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.756 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -51.04 -32.39 21.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.656 0.265 . . . . 0.0 111.558 179.9 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.94 -60.98 2.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.686 -179.226 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.677 ' NH1' ' HA ' ' A' ' 44' ' ' TRP . 0.2 OUTLIER -61.42 -27.92 68.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.711 -179.397 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 39.3 t -62.15 -52.67 62.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.726 0.298 . . . . 0.0 111.51 -179.663 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.514 ' HA ' HG11 ' A' ' 85' ' ' VAL . 8.3 mp -55.72 -60.72 3.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.645 -179.83 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -55.57 -24.65 33.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.968 0.413 . . . . 0.0 110.566 179.644 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.469 HE22 ' HE ' ' A' ' 75' ' ' ARG . 3.1 mt-30 -70.87 -48.25 54.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.132 179.806 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 79.5 mt -71.97 -60.71 2.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.4 -179.494 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.446 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 67.75 121.33 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.729 -179.943 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.513 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 146.11 179.72 22.51 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.762 179.935 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -66.06 -31.72 72.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.919 0.39 . . . . 0.0 110.603 -179.97 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.557 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.59 -52.31 64.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.069 -179.744 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.557 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.1 OUTLIER -70.37 -22.88 24.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.981 0.419 . . . . 0.0 110.518 179.693 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -58.63 -22.15 55.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.382 179.503 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 90' ' ' GLU . . . -76.69 -32.26 57.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.317 179.602 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.23 -48.8 77.91 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.982 179.156 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.589 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -72.12 -24.43 61.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.556 179.115 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.496 ' N ' ' HE2' ' A' ' 89' ' ' MET . 19.8 mm-40 -66.74 -35.05 79.19 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.999 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -81.49 -28.84 33.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.815 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.767 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.5 OUTLIER -85.67 -35.03 21.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.605 0.24 . . . . 0.0 110.864 -179.288 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -55.55 -28.47 55.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.963 0.411 . . . . 0.0 110.496 179.104 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.22 -26.17 39.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.386 179.934 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 50.0 p -117.6 30.96 6.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.615 179.2 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.421 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -53.35 121.55 17.45 Favored Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 115.186 -0.915 . . . . 0.0 113.539 -178.999 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.429 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 29.4 m -154.13 130.27 10.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.833 0.349 . . . . 0.0 110.682 179.124 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.04 -158.45 25.35 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.904 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -55.35 -33.18 63.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.608 0.242 . . . . 0.0 111.247 179.972 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.716 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -48.55 -48.05 38.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.316 -179.913 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.429 ' HB2' ' N ' ' A' ' 97' ' ' THR . 72.0 ttt180 -60.23 -58.35 8.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.994 -179.618 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -45.89 -24.91 0.45 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.381 -179.08 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 40.3 t -68.37 -52.98 31.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.367 179.763 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.767 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -53.41 -63.03 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.499 0.666 . . . . 0.0 112.375 -179.374 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.472 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 32.8 t -52.18 -62.83 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.779 -1.1 . . . . 0.0 113.412 -178.355 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -55.45 -34.22 64.29 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -178.236 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -59.42 -28.53 67.02 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-O 120.987 0.422 . . . . 0.0 111.145 -179.031 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 15.2 mt -62.13 -14.99 42.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.61 179.949 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -79.36 5.81 11.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.863 -179.411 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 35.5 p -146.63 -34.19 0.29 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.734 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.413 ' OXT' ' HA2' ' A' ' 81' ' ' GLY . 40.8 m80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.293 -179.125 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.848 0.356 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.513 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 15.0 t80 -63.3 -37.15 86.15 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.151 0.501 . . . . 0.0 110.425 179.86 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.412 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 1.1 mp0 -63.28 -57.68 19.36 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.998 179.759 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.5 Cg_endo -56.08 -14.5 11.7 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 121.484 1.456 . . . . 0.0 110.13 179.235 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.426 ' HB3' ' O ' ' A' ' 24' ' ' PHE . 0.7 OUTLIER -86.86 -37.45 17.7 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.285 -1.325 . . . . 0.0 109.089 178.451 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 28' ' ' LEU . 3.4 tm? -75.96 -31.41 59.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.824 179.459 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -71.31 -15.47 62.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.416 179.917 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.417 ' HB3' HG22 ' A' ' 38' ' ' ILE . 65.2 m -66.45 -51.5 56.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.14 -179.125 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.504 HD21 HD22 ' A' ' 28' ' ' LEU . 2.4 pp -60.45 -7.71 2.26 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.7 0.286 . . . . 0.0 111.527 -179.329 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.9 m -88.93 19.71 3.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.85 0.357 . . . . 0.0 110.449 179.529 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -105.08 150.57 24.89 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.094 179.951 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -67.38 -12.37 60.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.678 179.526 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -76.0 153.57 36.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.651 -179.929 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.3 m95 -102.78 -32.81 9.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.082 -179.7 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.527 ' HG3' HG13 ' A' ' 38' ' ' ILE . 34.0 ptt180 -62.0 -39.49 92.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.938 179.981 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.527 HG13 ' HG3' ' A' ' 37' ' ' ARG . 40.9 mt -82.22 -32.32 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.999 0.428 . . . . 0.0 110.517 179.475 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -38.83 78.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.302 -179.988 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.53 -53.97 7.07 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.879 -179.462 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.41 -39.14 46.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.709 0.29 . . . . 0.0 111.76 -179.912 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.407 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -64.4 -33.45 75.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.24 -179.759 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.441 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -85.44 -28.88 24.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.383 -179.88 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.0 m95 -69.53 -31.54 69.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.267 -178.778 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.8 mt -99.29 -19.43 5.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.981 0.42 . . . . 0.0 111.199 -179.246 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.554 HG12 ' HA ' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -51.17 -27.53 6.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.826 -179.346 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -93.11 -22.67 26.9 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.111 -179.084 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -69.84 -12.07 61.34 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 -179.589 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.419 ' HB2' ' HE2' ' A' ' 24' ' ' PHE . 22.2 m-85 -101.94 -35.66 8.91 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.747 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.436 ' HG2' HG23 ' A' ' 80' ' ' ILE . 1.4 tt0 69.61 72.06 0.24 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 0.0 110.843 179.622 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -126.68 170.53 12.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.277 179.876 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.553 ' O ' HG22 ' A' ' 55' ' ' VAL . 0.5 OUTLIER -66.43 -38.84 88.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.623 -179.292 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.458 ' HB2' ' HE1' ' A' ' 24' ' ' PHE . 0.2 OUTLIER -69.2 -9.98 55.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -179.614 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.554 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -88.59 10.61 19.88 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.902 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.553 HG22 ' O ' ' A' ' 52' ' ' GLU . 27.4 m -92.47 -49.21 13.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.851 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.525 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -60.42 -51.95 76.41 Favored Pre-proline 0 CA--C 1.533 0.297 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.963 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.525 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 71.8 Cg_exo -41.56 -53.06 3.43 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 122.404 2.069 . . . . 0.0 112.536 -179.898 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.445 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 8.4 mt -52.1 -47.87 65.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.693 -179.399 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 51.2 mt -54.76 -56.91 8.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.208 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.442 ' HB2' ' NZ ' ' A' ' 60' ' ' LYS . 0.1 OUTLIER -69.68 -16.2 63.31 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -178.876 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.885 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.6 OUTLIER -88.85 -46.26 9.08 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.303 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.845 HD13 HD11 ' A' ' 92' ' ' LEU . 7.1 mt -59.61 -15.06 16.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.176 0.512 . . . . 0.0 110.208 -179.306 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -112.31 -11.71 13.67 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.281 179.322 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.551 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 7.1 t70 -61.32 -32.12 71.98 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.772 -179.758 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.653 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 1.3 m-20 57.09 27.18 12.99 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.583 -179.82 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.522 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.5 t -85.55 -3.35 58.84 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.161 -179.941 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.83 -73.34 2.57 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.503 179.914 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -70.32 -43.53 70.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.022 0.439 . . . . 0.0 110.029 179.536 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.885 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.7 t -73.83 -33.49 37.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.386 179.949 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.701 HH21 ' H ' ' A' ' 100' ' ' ALA . 62.5 ttt180 -77.49 -53.58 7.45 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.128 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.484 ' O ' ' HG3' ' A' ' 75' ' ' ARG . 90.8 p -50.8 -55.45 16.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.572 -178.949 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -45.35 -32.3 3.71 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 121.202 -0.523 . . . . 0.0 113.071 -179.553 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.445 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -69.47 -48.83 59.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.646 0.26 . . . . 0.0 111.179 179.94 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.65 -35.77 66.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.283 -179.616 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 71' ' ' SER . 8.8 mtp85 -74.27 -34.04 63.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.319 179.874 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.0 t -61.44 -37.02 82.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.709 -179.318 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.679 HD11 HD11 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -59.95 -60.2 4.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.648 0.261 . . . . 0.0 111.072 179.944 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.405 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 10.8 pt-20 -59.44 -29.36 67.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.262 179.486 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -70.67 -36.86 73.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.758 0.313 . . . . 0.0 110.761 179.647 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.436 HG23 ' HG2' ' A' ' 50' ' ' GLN . 94.2 mt -80.3 -61.51 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.528 -179.692 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.44 122.47 0.01 OUTLIER Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.664 -179.846 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.436 ' O ' HG23 ' A' ' 85' ' ' VAL . . . 145.91 171.02 15.05 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.624 -179.992 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.63 -26.97 68.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.643 0.258 . . . . 0.0 111.384 -179.752 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.508 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -62.22 -49.26 76.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.028 0.442 . . . . 0.0 110.288 179.785 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.581 HG11 ' HA ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -70.85 -23.73 24.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.16 179.947 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 82' ' ' GLY . 98.5 mtt180 -58.64 -27.76 65.03 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.871 0.367 . . . . 0.0 110.558 179.533 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 91' ' ' LYS . . . -72.34 -29.09 63.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.145 179.585 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.36 -45.39 63.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.843 179.738 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.511 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.29 -33.08 71.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.886 0.374 . . . . 0.0 110.26 179.562 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.96 -34.67 76.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.921 178.915 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 29.8 mmmt -61.0 -40.77 94.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.978 179.223 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.845 HD11 HD13 ' A' ' 62' ' ' LEU . 66.1 mt -71.21 -38.54 72.03 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.988 179.836 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.458 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -52.76 -27.7 19.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.441 179.84 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -97.49 -10.49 25.25 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 -179.404 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.473 ' OG1' ' HA ' ' A' ' 92' ' ' LEU . 47.4 p -106.16 -31.42 8.69 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.72 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.556 ' HA2' ' HD3' ' A' ' 101' ' ' ARG . . . 52.67 92.9 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.877 -179.866 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.441 ' H ' ' HB2' ' A' ' 101' ' ' ARG . 79.7 m -140.24 129.23 23.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.39 . . . . 0.0 111.575 179.934 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.439 ' HA3' HH22 ' A' ' 70' ' ' ARG . . . 38.72 -127.88 1.88 Allowed Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.548 -0.751 . . . . 0.0 113.767 179.498 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.437 ' HD1' ' H ' ' A' ' 99' ' ' PHE . 0.4 OUTLIER -92.81 -21.88 19.64 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.479 0.18 . . . . 0.0 110.982 -179.703 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.701 ' H ' HH21 ' A' ' 70' ' ' ARG . . . -49.93 -40.03 42.21 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.009 0.433 . . . . 0.0 110.654 179.815 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.556 ' HD3' ' HA2' ' A' ' 96' ' ' GLY . 30.7 tpt85 -57.27 -61.56 2.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.639 179.508 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -55.66 -39.55 71.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.155 179.392 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 99' ' ' PHE . 35.3 t -60.88 -36.69 73.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.112 179.901 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.557 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -63.42 -60.95 2.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.858 -179.169 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.555 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 58.6 t -60.89 -40.49 85.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.844 -179.205 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -71.1 -28.66 64.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.823 179.743 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.405 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 4.5 t80 -63.51 -50.31 70.11 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -177.8 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 3.2 pp -52.33 -13.32 0.33 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.496 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -78.05 5.91 8.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.962 0.41 . . . . 0.0 110.715 179.335 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.5 m -124.47 -59.6 1.45 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.08 179.94 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 53.1 p-80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.442 179.807 . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.475 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.231 0.105 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 . . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.522 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -63.2 -49.68 73.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.026 0.441 . . . . 0.0 110.649 179.933 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -63.32 -53.43 53.17 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.116 179.838 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.475 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 83.7 Cg_exo -41.73 -24.57 0.27 Allowed 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 122.327 2.018 . . . . 0.0 111.961 179.554 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 70.2 mt -75.91 -57.02 4.12 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.473 178.997 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.657 HD12 HD12 ' A' ' 31' ' ' LEU . 28.5 tp -62.86 -24.56 67.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.101 179.938 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.2 -45.93 37.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 -179.598 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.2 p -63.29 -15.02 55.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.348 -179.8 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.657 HD12 HD12 ' A' ' 28' ' ' LEU . 57.0 mt -63.7 -10.96 22.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.84 0.352 . . . . 0.0 111.03 179.982 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.7 t -95.82 23.33 6.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.679 179.864 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.594 HD21 ' HB2' ' A' ' 39' ' ' ARG . 1.3 p30 -88.7 148.06 24.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.95 -179.614 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -65.6 -29.25 69.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.534 -179.386 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -77.88 163.63 25.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 0.0 111.066 -179.782 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -105.04 -24.94 12.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.594 -179.879 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 56.0 mtm180 -60.9 -39.13 88.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.193 179.736 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.7 mt -79.0 -45.57 24.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.453 -179.508 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.594 ' HB2' HD21 ' A' ' 33' ' ' ASN . 32.0 ttm180 -59.51 -41.3 89.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.23 -179.52 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.684 ' HA2' HD21 ' A' ' 61' ' ' LEU . . . -65.09 -62.84 4.59 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.001 -179.534 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.92 -24.74 2.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.745 0.307 . . . . 0.0 111.187 179.984 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.423 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -63.07 -55.01 29.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.758 179.465 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.403 ' HA ' ' CG2' ' A' ' 46' ' ' ILE . . . -68.02 -22.51 64.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.957 0.408 . . . . 0.0 110.716 179.71 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.404 ' CD1' ' HA3' ' A' ' 72' ' ' GLY . 4.3 m95 -56.91 -47.11 81.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.588 -179.967 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.47 HD12 ' N ' ' A' ' 45' ' ' ILE . 4.4 mp -99.5 -20.69 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.0 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.656 HG23 ' HB1' ' A' ' 54' ' ' ALA . 4.1 tt -55.43 -39.21 52.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -178.269 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.509 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -75.45 -11.44 84.29 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.512 -179.079 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -70.69 -10.98 60.63 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.149 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -95.59 -4.19 45.01 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.403 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.567 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.9 OUTLIER 46.41 56.27 6.54 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 179.494 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -127.3 151.29 48.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.893 0.377 . . . . 0.0 110.886 179.723 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.466 ' O ' HG12 ' A' ' 55' ' ' VAL . 9.4 pt-20 -59.8 -22.9 62.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.833 179.717 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.45 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -65.82 -30.64 71.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.643 179.685 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.656 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -102.18 30.54 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.471 -178.967 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.556 HG13 ' N ' ' A' ' 56' ' ' GLU . 9.9 p -91.39 -54.33 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.62 -179.964 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.556 ' N ' HG13 ' A' ' 55' ' ' VAL . 10.5 tt0 -61.0 -49.7 87.89 Favored Pre-proline 0 CA--C 1.536 0.406 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.797 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.5 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 81.5 Cg_exo -43.53 -36.73 7.26 Favored 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.5 2.133 . . . . 0.0 113.023 -179.313 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.656 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 27.5 mt -71.24 -47.14 59.0 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.07 -179.658 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.43 ' HA ' HD21 ' A' ' 62' ' ' LEU . 25.3 mt -59.4 -49.38 83.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.969 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.08 -26.81 64.17 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -177.759 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.684 HD21 ' HA2' ' A' ' 40' ' ' GLY . 21.8 tp -90.08 -30.62 17.58 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -178.236 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.612 HD11 HD22 ' A' ' 92' ' ' LEU . 4.0 pp -68.49 -8.9 45.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.121 0.486 . . . . 0.0 110.703 -179.124 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -112.32 0.27 15.64 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.018 179.298 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -61.92 -31.76 72.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.793 -179.668 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.553 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 14.6 t70 59.77 24.8 13.76 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.684 179.576 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.38 -20.61 43.65 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.028 0.442 . . . . 0.0 110.076 179.392 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 128.45 -110.03 1.08 Allowed Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.726 179.49 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -56.86 -23.97 48.19 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.846 0.355 . . . . 0.0 110.084 -179.949 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.589 ' HB ' HD11 ' A' ' 61' ' ' LEU . 3.7 m -69.15 -37.33 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-O 121.35 0.595 . . . . 0.0 110.013 179.298 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.553 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 3.8 ttm180 -63.0 -53.52 52.71 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.529 179.776 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 72.1 m -67.17 -38.7 85.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.424 179.935 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.404 ' HA3' ' CD1' ' A' ' 44' ' ' TRP . . . -52.53 -61.76 6.42 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.617 -179.668 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.656 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -59.06 -34.76 72.33 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.684 0.278 . . . . 0.0 111.073 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.412 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.2 -58.04 9.96 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.964 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 10.2 ptp180 -55.09 -34.39 63.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.507 -179.02 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.634 ' HA ' HE21 ' A' ' 79' ' ' GLN . 49.9 m -57.16 -34.03 68.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.641 0.258 . . . . 0.0 111.192 179.963 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.4 mp -60.47 -61.08 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.753 0.311 . . . . 0.0 110.977 179.592 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.424 ' HG2' ' HB2' ' A' ' 107' ' ' TYR . 42.9 mt-10 -64.47 -19.23 65.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.274 0.559 . . . . 0.0 110.102 179.073 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.634 HE21 ' HA ' ' A' ' 76' ' ' SER . 8.7 tt0 -70.78 -29.45 65.66 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.705 179.929 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.567 HG23 ' HG3' ' A' ' 50' ' ' GLN . 85.3 mt -84.52 -60.18 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.103 179.961 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.5 123.43 0.04 OUTLIER Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.623 179.908 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 137.45 172.88 12.69 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.576 179.802 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.25 -22.07 27.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.006 0.431 . . . . 0.0 111.074 179.826 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.582 ' HD3' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.94 -63.09 1.37 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.302 -179.872 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.546 HG21 ' HB ' ' A' ' 80' ' ' ILE . 20.3 t -70.67 -21.11 22.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.991 179.687 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.465 ' HA ' ' SD ' ' A' ' 89' ' ' MET . 68.3 mtt180 -53.31 -24.16 11.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.769 -179.529 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.87 -36.47 28.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.409 179.197 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.52 -39.33 70.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.872 -179.987 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.502 ' SD ' ' HB3' ' A' ' 108' ' ' LEU . 19.1 ptt? -63.75 -38.8 92.45 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -179.745 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -68.05 -26.49 65.88 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.446 178.656 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? -72.36 -41.94 65.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.483 179.403 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.612 HD22 HD11 ' A' ' 62' ' ' LEU . 8.8 mt -65.37 -38.42 89.98 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.604 179.917 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.75 -29.65 40.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.734 179.556 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -83.19 -24.62 32.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.352 179.049 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.3 p -114.58 31.49 6.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.178 179.367 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.531 ' HA3' HH11 ' A' ' 101' ' ' ARG . . . -45.96 99.15 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.698 -0.683 . . . . 0.0 113.291 -179.355 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.7 m -146.78 130.74 17.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.738 0.304 . . . . 0.0 110.28 179.618 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.87 -144.97 33.15 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.436 -0.888 . . . . 0.0 111.685 -179.386 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.45 -16.01 22.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.782 0.325 . . . . 0.0 110.547 179.604 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.437 ' HB1' HD13 ' A' ' 62' ' ' LEU . . . -55.79 -29.47 59.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.456 179.701 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.531 HH11 ' HA3' ' A' ' 96' ' ' GLY . 16.0 tpt180 -67.36 -57.67 6.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.996 178.844 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -49.38 -34.7 16.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.955 179.004 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.412 HG21 ' HB1' ' A' ' 74' ' ' ALA . 38.5 t -61.25 -55.45 24.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.15 179.785 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.565 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -56.18 -61.64 2.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.859 -179.277 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.482 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 45.1 t -50.76 -52.91 15.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.943 -179.304 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -71.13 -19.66 62.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.305 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.443 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 3.0 t80 -64.31 -51.83 61.49 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -177.721 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.502 ' HB3' ' SD ' ' A' ' 89' ' ' MET . 1.9 pp -52.07 -14.99 0.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.076 -178.982 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -72.41 3.33 4.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.727 0.299 . . . . 0.0 110.62 179.56 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.1 p -141.51 -47.95 0.39 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.268 -179.845 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 43.7 p-80 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.518 -179.971 . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.479 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 120.94 0.4 . . . . 0.0 110.497 . . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.701 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 4.2 t80 -63.45 -39.49 94.61 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.951 -179.962 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.428 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 39.1 mt-10 -57.27 -55.13 47.49 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.228 -179.312 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.479 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 91.8 Cg_exo -37.54 -30.24 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 C-N-CA 122.627 2.218 . . . . 0.0 111.997 179.079 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.575 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 22.7 mt -71.28 -58.71 3.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.828 179.212 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.569 ' HA ' HD12 ' A' ' 31' ' ' LEU . 41.9 tp -62.8 -21.45 65.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.896 179.997 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -79.55 -47.76 14.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.669 -179.905 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.8 m -66.41 -13.3 60.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.76 -179.758 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.569 HD12 ' HA ' ' A' ' 28' ' ' LEU . 46.8 mt -62.59 -10.27 11.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.658 0.266 . . . . 0.0 111.344 -179.733 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 35.9 m -89.96 6.88 40.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.893 179.933 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.603 HD22 ' HB ' ' A' ' 38' ' ' ILE . 21.6 p-10 -83.4 141.01 32.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.145 0.498 . . . . 0.0 111.327 -179.827 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.88 -9.57 45.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.855 -179.745 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.443 ' HB3' ' ND2' ' A' ' 33' ' ' ASN . 8.8 t70 -78.61 147.53 33.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.815 0.34 . . . . 0.0 111.108 -179.495 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.8 p-90 -98.62 -37.31 9.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.345 -179.792 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.2 tpt180 -59.51 -43.26 93.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.167 -179.877 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.603 ' HB ' HD22 ' A' ' 33' ' ' ASN . 44.7 mt -78.07 -49.48 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.219 -179.784 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.565 ' HE ' HG11 ' A' ' 69' ' ' VAL . 42.8 ttp180 -54.87 -30.92 59.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.853 179.824 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.09 -58.92 6.25 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.52 -179.926 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.56 -27.73 2.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.774 0.321 . . . . 0.0 111.329 -179.942 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.437 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.32 -51.96 66.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 179.797 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.554 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -73.17 -31.01 63.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.174 179.867 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.6 m95 -55.92 -37.64 69.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.441 -179.632 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.5 mt -99.56 -22.91 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.078 0.466 . . . . 0.0 110.907 -179.626 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.555 HG12 ' HA ' ' A' ' 54' ' ' ALA . 0.0 OUTLIER -51.35 -39.56 21.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.33 -178.853 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -76.86 -25.7 64.09 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.655 -0.783 . . . . 0.0 113.767 -178.868 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -70.82 -2.05 13.6 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -178.769 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.457 ' HB2' ' HE2' ' A' ' 24' ' ' PHE . 22.4 m-30 -112.71 -12.47 13.37 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.437 -0.505 . . . . 0.0 112.2 -179.449 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.524 ' HG2' HG23 ' A' ' 80' ' ' ILE . 0.6 OUTLIER 53.21 68.93 0.76 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.796 0.332 . . . . 0.0 111.212 179.331 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -127.48 164.25 22.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.869 0.366 . . . . 0.0 111.026 179.963 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -63.34 -43.72 96.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.78 179.564 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -6.53 21.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.29 -179.991 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.701 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -93.89 1.44 56.36 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.037 0.446 . . . . 0.0 111.041 -178.926 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.7 t -91.34 -49.13 13.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.24 -178.728 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.472 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 43.6 tt0 -60.23 -48.79 93.27 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.105 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.472 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 93.6 Cg_exo -43.06 -42.93 9.66 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.381 2.054 . . . . 0.0 112.873 -179.878 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.48 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 4.0 mt -66.35 -36.68 83.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.265 -179.284 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 29.2 mm -59.45 -59.03 4.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.192 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -70.05 -20.79 63.22 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.355 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.667 ' HG ' ' HB ' ' A' ' 69' ' ' VAL . 5.3 mp -83.38 -46.06 12.99 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -178.385 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.479 HD13 HD22 ' A' ' 92' ' ' LEU . 52.9 mt -61.37 -10.9 8.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.091 0.472 . . . . 0.0 110.5 -179.338 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.75 -17.05 13.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.285 179.126 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -62.09 -38.84 90.4 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.936 -179.68 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.566 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 5.3 m-20 57.74 27.39 14.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.712 -179.947 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.81 -25.67 59.18 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.003 0.43 . . . . 0.0 110.326 179.557 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 120.7 -82.12 0.34 Allowed Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.408 179.861 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.74 -33.23 75.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.295 0.569 . . . . 0.0 109.613 179.179 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.667 ' HB ' ' HG ' ' A' ' 61' ' ' LEU . 3.2 m -71.91 -42.14 69.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.473 -179.767 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.566 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 25.7 ttp180 -75.48 -47.57 26.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.076 -179.172 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 46.6 t -58.81 -50.29 74.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.482 179.605 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.9 -51.04 56.13 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.918 179.486 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.48 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -56.52 -33.42 66.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.673 0.273 . . . . 0.0 110.977 179.364 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.91 -54.19 45.39 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.54 -179.546 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.41 ' H ' ' HG2' ' A' ' 75' ' ' ARG . 10.2 ptp180 -69.76 -19.5 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.732 -179.589 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 59.8 m -58.74 -47.59 84.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.576 -179.863 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.468 ' HA ' HG21 ' A' ' 85' ' ' VAL . 6.3 mp -56.44 -54.9 40.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.846 -179.973 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.459 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 47.0 mt-10 -49.07 -34.0 12.76 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.422 179.463 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -69.91 -41.62 74.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.015 -179.997 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.524 HG23 ' HG2' ' A' ' 50' ' ' GLN . 88.4 mt -69.3 -61.02 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.943 179.645 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.49 113.83 0.01 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.119 -0.562 . . . . 0.0 112.989 179.658 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.433 ' O ' HG12 ' A' ' 85' ' ' VAL . . . 156.01 175.2 26.73 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.781 179.709 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.26 -23.34 61.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.841 0.353 . . . . 0.0 110.802 179.724 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.639 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.83 -45.48 61.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.046 -179.796 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.639 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 8.8 p -71.05 -26.47 27.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.231 0.538 . . . . 0.0 110.647 179.761 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.429 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 6.1 ttt180 -53.76 -28.76 36.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.798 179.581 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.18 -32.12 73.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.717 179.71 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.18 -57.89 10.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.343 -179.972 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.577 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.15 -24.61 65.0 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.822 -179.886 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.402 ' N ' ' SD ' ' A' ' 89' ' ' MET . 2.1 tm-20 -63.89 -44.19 93.77 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.119 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -72.22 -22.22 61.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.114 179.533 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.534 HD21 ' O ' ' A' ' 100' ' ' ALA . 0.3 OUTLIER -86.57 -28.54 23.25 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 120.81 0.338 . . . . 0.0 110.269 179.978 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.0 -19.15 65.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.948 179.667 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -84.56 -24.9 29.04 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.177 179.619 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 42.5 p -120.38 19.06 12.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.893 179.101 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -49.75 121.27 9.02 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.271 -179.263 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.6 t -142.59 130.66 21.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.842 0.354 . . . . 0.0 110.987 179.556 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.85 -136.53 46.42 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.677 -179.943 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.502 ' O ' HG23 ' A' ' 103' ' ' VAL . 48.1 t80 -66.25 -34.86 78.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.786 0.327 . . . . 0.0 111.012 179.997 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.534 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.59 -33.84 34.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.979 -179.59 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.0 ttp180 -72.63 -55.36 6.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.512 -179.408 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -49.25 -21.64 0.86 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.233 0.54 . . . . 0.0 110.484 179.722 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 99' ' ' PHE . 55.2 t -71.01 -58.77 4.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.609 179.81 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.577 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.88 -47.57 82.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.276 0.56 . . . . 0.0 112.368 -179.278 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.533 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 40.2 t -64.91 -51.5 65.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.342 -0.844 . . . . 0.0 112.878 -178.042 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -64.0 -45.36 89.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.671 0.272 . . . . 0.0 111.519 -179.248 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.459 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 61.1 t80 -60.44 -22.55 63.56 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.68 -179.049 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.533 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.0 OUTLIER -55.13 -18.11 5.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.089 179.884 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -71.47 -1.3 12.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.813 179.691 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 4.0 m -145.45 32.75 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.443 -179.981 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.1 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.961 179.84 . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.61 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.463 0.178 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 . . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.574 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -52.25 -50.17 62.59 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.975 0.417 . . . . 0.0 110.463 179.553 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.495 ' HA ' HD23 ' A' ' 28' ' ' LEU . 3.7 mt-10 -63.36 -57.87 18.31 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.802 179.636 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.61 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 74.6 Cg_exo -43.73 -30.88 3.1 Favored 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 122.077 1.851 . . . . 0.0 111.554 179.795 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.574 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 36.6 mt -62.8 -56.85 13.75 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.354 178.918 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.588 HD22 ' HB2' ' A' ' 53' ' ' ARG . 0.9 OUTLIER -69.82 -19.6 63.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.126 179.515 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -73.33 -39.57 65.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.781 179.552 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.0 m -66.42 -7.18 17.7 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.116 179.778 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.49 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 96.4 mt -61.24 -19.87 62.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.914 0.388 . . . . 0.0 110.479 179.626 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 83.4 p -92.51 12.05 24.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.074 179.968 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -72.55 139.15 47.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.777 -179.762 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.39 -31.78 73.03 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.855 -179.942 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -77.39 147.97 35.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.495 179.782 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 25.8 p-90 -89.44 -40.24 12.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.463 -179.473 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -60.28 -25.52 65.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.913 0.387 . . . . 0.0 110.723 179.756 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.3 mm -81.08 -47.77 19.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.087 179.974 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.49 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 49.4 ttp180 -63.73 -22.08 66.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.877 179.901 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.48 ' HA2' ' HA ' ' A' ' 69' ' ' VAL . . . -69.04 -59.16 6.09 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.606 -179.885 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' ' 44' ' ' TRP . . . -50.26 -20.37 1.04 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.704 0.288 . . . . 0.0 111.597 180.0 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.86 -55.09 37.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.354 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.592 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -73.81 -25.47 60.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.175 -179.959 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.403 ' HB2' ' HA ' ' A' ' 41' ' ' ALA . 6.7 m95 -55.46 -36.95 67.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.211 -179.586 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.0 mt -100.1 -26.14 3.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.039 0.447 . . . . 0.0 111.128 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.592 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 0.9 OUTLIER -56.3 -46.61 81.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.34 -178.873 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.406 ' N ' HG22 ' A' ' 46' ' ' ILE . . . -61.35 -21.61 60.08 Favored Glycine 0 CA--C 1.518 0.281 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.391 -179.058 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -70.71 -20.9 62.62 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 -179.064 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -92.08 -28.78 16.92 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.142 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 63.72 27.31 14.71 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 179.367 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.511 ' O ' HG23 ' A' ' 55' ' ' VAL . 12.0 t70 -96.12 170.03 9.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.767 0.317 . . . . 0.0 111.272 -179.866 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -54.12 -52.09 62.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.038 179.672 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.588 ' HB2' HD22 ' A' ' 28' ' ' LEU . 3.2 ptt180 -61.6 -8.47 4.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.225 179.66 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.543 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -104.97 -21.0 13.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.92 0.391 . . . . 0.0 111.067 -179.691 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 51' ' ' ASP . 69.5 t -73.58 -54.17 16.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.694 -179.633 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.452 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 25.5 tt0 -54.21 -47.7 96.57 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -179.527 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.501 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 97.2 Cg_exo -42.08 -46.92 7.02 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 122.489 2.126 . . . . 0.0 112.561 179.623 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.553 HD13 HD22 ' A' ' 77' ' ' LEU . 6.1 mt -63.48 -42.34 98.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.938 -179.592 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.0 mm -51.46 -54.84 10.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.345 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -70.06 -47.89 60.09 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.278 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.682 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.1 mp -60.17 -40.55 90.35 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.054 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.637 HD11 HD21 ' A' ' 77' ' ' LEU . 37.2 mt -56.77 -15.71 5.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.287 0.565 . . . . 0.0 109.999 -179.555 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -99.57 -30.98 11.83 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.293 178.235 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -62.21 87.77 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.174 178.957 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.465 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 16.6 m-20 -73.91 41.91 0.13 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.246 -178.798 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.9 t -85.75 -30.82 22.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.782 0.325 . . . . 0.0 111.125 179.763 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 126.46 -106.54 0.85 Allowed Glycine 0 C--O 1.228 -0.267 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.996 -179.686 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -46.7 -29.73 2.03 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.631 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.682 HG12 ' HG ' ' A' ' 61' ' ' LEU . 47.0 t -68.19 -54.98 18.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.963 179.559 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.465 ' HE ' ' HA ' ' A' ' 65' ' ' ASP . 0.2 OUTLIER -66.79 -54.69 20.07 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.257 179.736 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.3 m -50.95 -31.3 17.37 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.536 -179.614 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.46 -46.12 95.0 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.429 179.922 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.438 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . . . -70.21 -32.94 71.06 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 -179.837 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.34 -61.53 2.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.817 0.342 . . . . 0.0 111.648 -179.189 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 75' ' ' ARG . 6.4 ptp180 -60.68 -20.48 61.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.746 -179.425 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.2 m -67.15 -36.03 80.96 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.27 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.637 HD21 HD11 ' A' ' 62' ' ' LEU . 4.2 mm? -54.81 -61.05 2.56 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.724 0.297 . . . . 0.0 111.416 179.748 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.5 ' HG2' ' HD1' ' A' ' 107' ' ' TYR . 37.6 mt-10 -56.36 -41.28 75.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.889 179.567 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -62.32 -40.96 98.06 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -178.772 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 72.9 mt -60.74 -59.77 3.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -179.176 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.492 ' H ' HG21 ' A' ' 85' ' ' VAL . . . 174.59 -124.92 1.05 Allowed Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.09 -1.053 . . . . 0.0 113.392 179.938 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.456 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . -146.64 -66.67 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.411 -0.899 . . . . 0.0 113.748 -179.099 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.59 -27.08 63.83 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.335 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.565 ' HD3' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -85.05 -48.34 9.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.863 0.363 . . . . 0.0 110.517 -179.277 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.579 HG12 HD13 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -70.85 -20.77 22.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.723 178.858 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -47.28 -29.66 2.6 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.637 179.088 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.74 -36.84 50.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.75 179.963 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.91 -47.64 84.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.919 179.615 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.664 ' HE3' ' HG3' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -67.6 -30.29 69.84 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.509 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.664 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 22.1 mt-10 -66.49 -33.89 76.71 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.122 179.171 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -70.72 -38.67 73.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.113 179.788 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.54 HD21 ' O ' ' A' ' 100' ' ' ALA . 0.1 OUTLIER -82.05 -23.66 35.74 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.652 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.31 -26.36 68.73 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.298 179.024 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -80.22 -26.76 38.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.708 179.887 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 58.3 p -112.54 23.02 14.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.171 178.54 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.452 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -56.07 116.1 6.92 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.064 -0.971 . . . . 0.0 113.508 -178.958 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.8 t -147.79 130.32 15.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.741 0.305 . . . . 0.0 110.72 179.05 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.07 -142.19 48.41 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.734 -179.833 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -62.54 -29.45 70.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 111.009 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.54 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -56.24 -37.63 70.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.505 -179.747 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.452 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 18.0 ttp180 -70.91 -55.55 8.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.622 -179.594 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 57.7 tttp -47.67 -23.18 0.63 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.163 0.506 . . . . 0.0 110.948 -179.872 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.431 HG11 HD22 ' A' ' 62' ' ' LEU . 17.8 t -68.4 -60.43 2.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.73 179.903 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.5 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.6 -56.28 24.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.38 -179.156 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.424 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 19.4 t -56.42 -63.17 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.026 -178.245 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 106' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 15.0 m120 -57.08 -27.72 61.99 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -178.674 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.5 ' HD1' ' HG2' ' A' ' 78' ' ' GLU . 4.4 t80 -59.83 -31.09 69.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.362 . . . . 0.0 110.359 179.768 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.424 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 16.6 mt -52.65 -23.77 7.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.107 179.619 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -58.87 -8.75 1.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.215 179.747 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.5 p -93.19 -54.0 3.89 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.553 179.443 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 61.7 m80 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.322 -0.847 . . . . 0.0 110.932 179.843 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mpp? . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.777 0.322 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 66.08 146.82 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.299 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -92.49 -0.26 57.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.01 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -105.38 -6.51 19.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.996 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -142.84 96.47 2.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.784 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -99.31 -35.68 9.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.259 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -88.98 144.15 26.36 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.991 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.8 p -175.71 104.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.393 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 59.49 19.02 7.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.58 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 12.1 ptp180 -65.97 104.86 1.2 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 20.7 t70 72.41 -10.89 0.87 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.946 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.604 HG12 ' H ' ' A' ' 13' ' ' SER . 3.5 t -84.14 171.78 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.535 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.604 ' H ' HG12 ' A' ' 12' ' ' VAL . 34.5 t -156.79 -24.69 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.681 0.276 . . . . 0.0 111.028 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.668 HG22 ' H ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -88.11 -168.53 2.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.467 179.815 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.668 ' H ' HG22 ' A' ' 14' ' ' THR . . . -94.87 -67.67 0.84 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.502 HD13 ' N ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -78.33 -11.72 59.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.985 -179.027 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.502 ' N ' HD13 ' A' ' 16' ' ' LEU . 46.1 t -45.56 -52.24 10.78 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -174.75 96.43 0.08 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.794 0.331 . . . . 0.0 111.542 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 24.7 mmt -133.7 -43.16 0.83 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.774 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.12 12.69 38.51 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.337 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -170.14 -59.29 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.825 0.345 . . . . 0.0 111.132 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -66.12 -16.75 64.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.416 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.438 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -99.35 -1.92 37.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.038 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.46 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 2.5 t80 -63.2 -51.57 65.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.244 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -63.4 -55.25 37.08 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.832 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.438 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 44.2 Cg_exo -50.91 -24.9 14.64 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 121.782 1.654 . . . . 0.0 110.349 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.666 HD21 HG13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -76.4 -41.75 46.77 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 114.207 -1.361 . . . . 0.0 109.218 178.912 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 31' ' ' LEU . 16.5 tp -70.47 -27.14 63.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.207 178.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -65.93 -41.11 91.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.124 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -61.38 -17.77 55.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.035 -0.53 . . . . 0.0 112.008 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 28' ' ' LEU . 80.1 mt -69.37 -11.89 61.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.788 0.328 . . . . 0.0 111.333 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.2 t -109.82 0.82 18.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.825 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -67.92 139.03 56.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.722 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -67.53 -24.03 65.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.315 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.67 139.79 33.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.919 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.1 p-90 -88.1 -26.4 22.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -64.08 -41.55 97.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.004 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.7 mt -80.18 -41.54 21.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.811 0.338 . . . . 0.0 111.122 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.536 ' HE ' HG21 ' A' ' 69' ' ' VAL . 54.1 ttp180 -59.48 -24.52 63.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.592 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.31 -63.61 3.85 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.635 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.61 -37.9 6.05 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.652 0.263 . . . . 0.0 111.258 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.438 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -57.45 -54.21 49.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.323 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.35 -30.81 71.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.703 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -68.47 -34.45 75.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.906 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.0 mt -99.37 -19.36 5.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.343 . . . . 0.0 111.762 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.666 HG13 HD21 ' A' ' 27' ' ' LEU . 3.9 tt -58.38 -34.92 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.24 -17.11 80.27 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.138 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -70.58 -7.15 41.87 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -99.18 -22.17 15.77 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.499 ' HG3' HG23 ' A' ' 80' ' ' ILE . 25.0 mp0 55.96 54.4 8.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 111.391 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -127.47 166.92 17.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.809 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -63.6 -29.11 70.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.663 ' HD2' HD22 ' A' ' 28' ' ' LEU . 1.1 ttp180 -66.33 -11.69 52.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.965 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.458 ' HA ' ' HG2' ' A' ' 57' ' ' PRO . . . -104.94 -13.59 15.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 86.8 t -68.9 -51.31 45.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.088 -179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.488 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 21.1 tt0 -59.75 -49.63 90.76 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.488 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.2 Cg_exo -41.22 -52.24 3.6 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.371 2.047 . . . . 0.0 112.898 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.627 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 5.2 mt -60.03 -36.93 78.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.384 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.6 mm -55.02 -59.83 2.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.875 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.44 ' HG3' HD13 ' A' ' 61' ' ' LEU . 3.9 ptpp? -70.76 -40.12 72.87 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.719 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -57.86 -51.58 69.03 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.465 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.799 HD13 HD22 ' A' ' 92' ' ' LEU . 33.5 mt -55.96 -10.34 0.77 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.716 0.294 . . . . 0.0 111.491 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.02 -20.32 13.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.991 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.419 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 6.5 m-20 -61.13 -40.3 93.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.714 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.446 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 29.5 t70 62.33 27.35 16.34 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.316 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.519 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 4.7 m -84.31 17.12 2.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.477 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.79 -96.58 0.68 Allowed Glycine 0 C--O 1.227 -0.337 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.747 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.09 -43.8 64.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.036 0.446 . . . . 0.0 110.61 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.719 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.8 t -73.35 -39.09 54.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.049 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.501 ' HG2' ' HA ' ' A' ' 62' ' ' LEU . 3.0 tmm_? -77.98 -63.6 1.35 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.668 0.27 . . . . 0.0 111.435 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 48.9 m -51.55 -32.25 27.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.305 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.438 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -63.4 -38.39 96.31 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.437 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.627 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -64.02 -37.37 87.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.704 0.288 . . . . 0.0 111.042 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.16 -57.14 14.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.762 -179.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 7.4 ptm85 -58.65 -26.93 64.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.618 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.2 m -58.49 -39.85 81.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.452 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.651 ' HA ' HG11 ' A' ' 85' ' ' VAL . 6.1 mp -59.79 -58.33 9.03 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.744 0.307 . . . . 0.0 110.631 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.456 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 54.1 mt-10 -48.96 -31.17 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.338 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.408 ' NE2' ' HG3' ' A' ' 75' ' ' ARG . 38.3 mt-30 -68.67 -41.93 78.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.141 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.499 HG23 ' HG3' ' A' ' 50' ' ' GLN . 35.3 mt -74.35 -60.87 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 63.14 117.6 0.01 OUTLIER Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.977 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.449 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 145.43 -173.05 25.98 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.753 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -69.45 -30.2 68.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.814 0.34 . . . . 0.0 110.902 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.553 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -52.85 -63.24 1.21 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.851 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.651 HG11 ' HA ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -70.93 -20.61 21.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.9 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 55.3 ttp180 -56.78 -26.35 57.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.253 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.16 -25.67 27.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.215 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.62 69.41 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.695 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.464 ' HB2' ' CB ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -69.09 -26.79 65.11 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.249 179.629 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 41.7 mt-10 -69.78 -32.26 70.64 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -76.76 -28.7 55.82 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.622 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.799 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -84.54 -30.08 25.39 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.515 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.57 -20.27 66.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.337 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -80.33 -26.86 38.54 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.674 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 51.3 p -118.2 24.4 10.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.827 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.425 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -55.85 116.41 7.19 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.338 -0.846 . . . . 0.0 113.261 -179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.3 t -140.52 130.24 24.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.828 0.347 . . . . 0.0 110.842 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.86 -135.67 51.79 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.631 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -67.64 -32.01 72.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.618 0.247 . . . . 0.0 111.315 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.548 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.84 -28.75 37.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.687 -179.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.425 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 21.9 ttp180 -75.22 -55.23 5.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.431 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -48.25 -26.95 2.19 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.21 0.529 . . . . 0.0 110.256 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.417 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 37.5 t -59.5 -60.04 3.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.868 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.62 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -62.59 -56.55 16.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.433 0.635 . . . . 0.0 111.957 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.589 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 54.8 t -52.38 -54.61 14.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 114.82 -1.082 . . . . 0.0 113.146 -178.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -70.74 -31.48 68.32 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.456 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 21.6 t80 -63.7 -50.96 67.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 4.3 pp -52.42 -15.02 0.55 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.456 -178.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -62.2 -13.71 30.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.088 0.47 . . . . 0.0 110.149 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.02 12.97 6.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.77 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.044 -0.979 . . . . 0.0 111.074 179.88 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtt . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.787 0.327 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -111.61 76.01 0.95 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.239 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 51.34 82.98 0.06 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.089 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -163.12 -63.39 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.83 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.401 ' OD1' HG21 ' A' ' 8' ' ' VAL . 65.0 t30 -130.26 97.08 4.32 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.792 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -137.91 174.5 10.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.7 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.428 ' HA ' ' HD3' ' A' ' 10' ' ' ARG . 40.7 m95 59.05 25.89 14.44 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.563 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.445 HG13 ' HA ' ' A' ' 22' ' ' GLU . 24.1 t -101.51 145.5 11.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.651 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.511 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 46.3 ttp180 61.04 13.58 4.74 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.789 179.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' A' ' 7' ' ' TRP . 30.8 mtm180 -66.0 104.36 1.11 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.3 t70 68.31 -3.86 1.21 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.193 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.511 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 41.3 t -77.37 129.69 37.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.897 0.38 . . . . 0.0 111.389 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.419 ' H ' ' H ' ' A' ' 14' ' ' THR . 89.0 p -164.39 -18.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.461 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.419 ' H ' ' H ' ' A' ' 13' ' ' SER . 58.5 p -137.72 -9.52 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.743 179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.11 -1.25 56.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.38 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.41 ' N ' HD23 ' A' ' 16' ' ' LEU . 2.3 pt? -46.94 -17.09 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.891 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 61.6 m -46.13 -44.57 15.87 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.81 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.449 HH12 HG23 ' A' ' 45' ' ' ILE . 18.0 tpp180 -173.47 100.34 0.12 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.387 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 94.9 mmm -132.77 -28.53 1.58 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.601 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 111.22 -133.17 11.35 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.168 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -70.5 -17.58 62.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.937 0.399 . . . . 0.0 110.53 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.445 ' HA ' HG13 ' A' ' 8' ' ' VAL . 27.9 mt-10 -72.42 -29.57 63.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.882 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -102.83 6.19 39.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.559 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.556 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -60.96 -53.86 52.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.154 0.502 . . . . 0.0 110.124 179.661 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -63.23 -54.92 40.97 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.013 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 91.9 Cg_exo -43.33 -26.38 0.93 Allowed 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.228 1.952 . . . . 0.0 111.458 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.556 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 43.5 mt -74.68 -55.3 6.03 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.937 178.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.608 HD12 HD11 ' A' ' 31' ' ' LEU . 38.1 tp -61.53 -20.96 63.81 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.599 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -80.68 -36.81 31.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.715 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.479 ' HB3' HG22 ' A' ' 38' ' ' ILE . 60.0 m -66.22 -42.42 88.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.859 -179.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.608 HD11 HD12 ' A' ' 28' ' ' LEU . 4.1 pp -63.32 -6.27 4.46 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.2 m -90.32 22.12 3.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.066 0.46 . . . . 0.0 110.525 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -117.5 144.58 44.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.029 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -65.89 -8.76 23.96 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.305 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -77.36 120.69 22.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.947 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -70.68 -35.88 73.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.827 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 53.1 ttp180 -60.11 -54.63 43.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.254 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.479 HG22 ' HB3' ' A' ' 30' ' ' SER . 64.0 mt -65.96 -45.65 90.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.804 0.335 . . . . 0.0 111.0 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.499 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.3 ttm180 -63.2 -20.69 65.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.58 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.65 -66.48 2.27 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.625 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.6 -40.31 19.03 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.688 0.28 . . . . 0.0 111.18 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.99 -52.72 63.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.075 0.464 . . . . 0.0 110.235 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.448 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -63.31 -36.19 82.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.665 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -63.16 -26.28 68.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.471 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.449 HG23 HH12 ' A' ' 18' ' ' ARG . 62.8 mt -99.26 -19.74 5.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.005 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.589 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.9 OUTLIER -55.39 -39.54 53.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.535 -179.738 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.19 -16.48 73.17 Favored Glycine 0 C--N 1.329 0.193 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.744 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.0 -45.93 86.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.831 0.348 . . . . 0.0 110.379 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.443 ' C ' ' H ' ' A' ' 51' ' ' ASP . 85.2 m-85 -85.54 111.87 20.41 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.659 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.544 ' HG3' HG23 ' A' ' 80' ' ' ILE . 13.7 mp0 -74.67 35.02 0.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.377 179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.443 ' H ' ' C ' ' A' ' 49' ' ' PHE . 35.6 t70 -100.66 155.31 17.96 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.84 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.488 ' O ' HG12 ' A' ' 55' ' ' VAL . 12.2 pt-20 -63.06 -23.58 67.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.544 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.459 ' HD3' HD22 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -57.69 -41.15 81.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.81 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.589 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -97.37 24.55 6.41 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 52' ' ' GLU . 2.7 p -91.41 -37.75 9.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.941 0.4 . . . . 0.0 111.062 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.521 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 24.8 tt0 -60.45 -51.13 82.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.98 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.571 ' HG2' HG12 ' A' ' 46' ' ' ILE . 88.5 Cg_exo -42.81 -52.36 4.67 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.397 2.065 . . . . 0.0 112.761 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.59 HD13 HD23 ' A' ' 77' ' ' LEU . 49.6 mt -56.73 -41.23 77.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.596 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 25.3 mm -53.17 -60.12 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -71.87 -31.04 66.06 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.63 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -66.08 -44.19 85.15 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.657 HD13 HD11 ' A' ' 92' ' ' LEU . 12.0 mt -62.68 -8.96 7.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.967 0.413 . . . . 0.0 110.564 -178.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -126.95 -6.2 6.15 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.27 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.43 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 3.7 t70 -61.17 -33.05 72.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.28 0.562 . . . . 0.0 110.745 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 42.7 m-20 58.75 25.75 13.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.292 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.454 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.1 m -86.04 5.59 32.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.623 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.98 -103.95 2.63 Favored Glycine 0 C--O 1.227 -0.306 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.44 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -50.44 -39.79 48.58 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.182 0.515 . . . . 0.0 110.127 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.63 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.4 t -67.98 -38.29 79.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.539 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 27.0 ttp180 -76.61 -58.87 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.294 -179.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 62.0 p -50.87 -30.18 13.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.326 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.17 -37.02 94.23 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.616 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.455 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -77.08 -36.92 55.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.61 0.243 . . . . 0.0 111.507 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.45 ' HB2' ' HE1' ' A' ' 99' ' ' PHE . . . -54.98 -49.59 71.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.799 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 7.3 ptp180 -73.68 -33.8 64.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.283 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 19.8 m -56.5 -39.97 74.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.034 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.59 HD23 HD13 ' A' ' 58' ' ' LEU . 90.1 mt -55.51 -59.58 4.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.747 0.308 . . . . 0.0 110.53 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -49.08 -29.99 5.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.804 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 20.2 mt-30 -68.68 -41.71 78.86 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.949 0.404 . . . . 0.0 110.257 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.544 HG23 ' HG3' ' A' ' 50' ' ' GLN . 71.6 mt -69.22 -61.48 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.12 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.405 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 58.94 111.3 0.01 OUTLIER Glycine 0 CA--C 1.518 0.27 0 C-N-CA 121.156 -0.545 . . . . 0.0 113.155 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.415 ' H ' ' HB3' ' A' ' 111' ' ' HIS . . . 165.83 174.26 35.15 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.593 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.93 -22.59 66.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.834 0.349 . . . . 0.0 110.547 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.601 ' HD3' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -75.76 -33.7 60.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.619 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.601 ' N ' ' HD3' ' A' ' 84' ' ' ARG . 3.4 t -68.53 -32.68 56.29 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-O 121.333 0.587 . . . . 0.0 109.756 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 86' ' ' ARG . 9.3 ttt180 -52.48 -26.61 13.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.777 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.29 -41.61 66.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.503 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.04 -43.07 88.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.116 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.437 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.98 -36.27 77.67 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.786 0.327 . . . . 0.0 110.387 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.62 -31.38 72.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.078 0.466 . . . . 0.0 109.976 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -65.59 -39.1 91.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.85 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.69 HD12 ' HB2' ' A' ' 104' ' ' ALA . 29.4 mt -70.94 -40.23 72.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.562 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.46 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -55.79 -22.34 23.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.937 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -92.26 -23.43 19.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.978 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 71.5 p -121.64 39.01 3.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.822 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.413 ' CA ' ' HD3' ' A' ' 101' ' ' ARG . . . -38.42 104.67 0.03 OUTLIER Glycine 0 C--N 1.332 0.353 0 CA-C-N 115.761 -0.654 . . . . 0.0 113.611 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.2 p -144.8 132.18 20.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.838 0.351 . . . . 0.0 110.927 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.69 -143.58 46.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.477 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.45 ' HE1' ' HB2' ' A' ' 74' ' ' ALA . 10.6 p90 -84.16 -24.29 30.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.698 0.285 . . . . 0.0 110.819 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.624 ' HB1' HD13 ' A' ' 92' ' ' LEU . . . -44.9 -36.8 3.51 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.47 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.46 ' NE ' ' HA ' ' A' ' 93' ' ' ALA . 14.1 tpt180 -64.3 -61.88 1.96 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -54.46 -33.37 59.51 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.201 0.524 . . . . 0.0 110.261 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 43.3 t -65.19 -44.7 95.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.075 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.69 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -64.99 -59.02 4.63 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 61.1 t -55.15 -62.68 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.612 -178.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -55.46 -38.21 68.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.723 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.405 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 9.5 t80 -58.82 -44.66 90.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.906 0.384 . . . . 0.0 111.644 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.436 ' O ' HD12 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -51.1 -17.74 0.7 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.026 -178.522 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -61.11 -8.94 3.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 111.004 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 56.1 p -122.29 -41.8 2.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.179 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.415 ' HB3' ' H ' ' A' ' 82' ' ' GLY . 71.6 m80 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.809 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.1 mtm . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.745 0.307 . . . . 0.0 110.962 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.96 26.69 10.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.249 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -92.9 -71.14 0.67 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.864 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -100.27 -44.64 5.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.922 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -95.15 102.06 13.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.053 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -110.67 -62.72 1.49 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.3 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -36.79 13.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.265 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.475 HG12 ' H ' ' A' ' 9' ' ' ARG . 1.7 t 49.6 -141.2 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.321 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.519 HH11 ' HG3' ' A' ' 26' ' ' PRO . 57.3 ttp180 -81.88 -7.21 59.59 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.647 0.261 . . . . 0.0 111.305 -179.164 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.414 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 62.9 ttt180 -58.17 129.87 43.98 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 30.9 m-20 66.31 14.7 9.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.89 0.376 . . . . 0.0 110.606 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 40.3 t -133.09 145.64 33.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.831 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.9 p -160.87 7.49 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.378 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.9 m -131.74 32.06 4.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.939 0.4 . . . . 0.0 111.075 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.447 ' HB1' ' HB2' ' A' ' 19' ' ' MET . . . -88.9 -2.45 58.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.242 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.622 ' HG ' ' HB1' ' A' ' 23' ' ' ALA . 5.4 mp -69.4 -18.76 63.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.505 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.2 t -47.14 -51.18 18.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.824 0.345 . . . . 0.0 111.044 -179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.403 ' H ' ' H ' ' A' ' 19' ' ' MET . 32.1 ttm180 -176.39 -7.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.362 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.447 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 4.3 mtp -57.95 -38.28 75.67 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.569 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 58.31 -170.6 4.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.795 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 61.31 -79.55 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.714 0.292 . . . . 0.0 111.18 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -55.54 -41.63 73.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.698 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.622 ' HB1' ' HG ' ' A' ' 16' ' ' LEU . . . -105.66 18.68 21.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.703 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.462 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 2.5 t80 -60.63 -46.54 89.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.508 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.42 -54.08 47.0 Favored Pre-proline 0 N--CA 1.466 0.329 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.431 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.519 ' HG3' HH11 ' A' ' 9' ' ' ARG . 53.0 Cg_exo -46.32 -23.88 2.28 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.902 1.735 . . . . 0.0 111.011 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.657 HD21 HG13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -83.96 -46.83 11.65 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 114.322 -1.308 . . . . 0.0 110.128 179.667 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.676 HD12 HD12 ' A' ' 31' ' ' LEU . 15.1 tp -69.13 -16.93 63.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.363 179.147 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -75.61 -36.57 60.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.771 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.4 m -66.34 -20.28 66.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.825 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.676 HD12 HD12 ' A' ' 28' ' ' LEU . 91.2 mt -65.86 -9.52 29.82 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.574 0.226 . . . . 0.0 111.542 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.5 m -101.5 11.69 38.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.079 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -71.47 148.04 47.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.018 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.43 -18.28 65.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.965 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -86.76 162.48 17.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.791 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -102.86 -39.62 6.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.798 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -58.74 -37.5 76.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.894 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.2 mm -61.59 -41.57 90.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.717 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.441 ' HB2' HG22 ' A' ' 69' ' ' VAL . 76.4 mtt180 -62.45 -24.5 67.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.398 179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.62 -64.36 3.63 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.858 -0.686 . . . . 0.0 112.197 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.74 -33.8 36.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.781 0.324 . . . . 0.0 110.948 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.34 -55.46 15.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.583 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.421 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -62.62 -26.01 68.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.742 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.435 ' NE1' ' HA2' ' A' ' 72' ' ' GLY . 5.3 m95 -70.63 -32.82 70.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.135 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.534 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 41.4 mt -99.46 -22.88 4.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.945 0.403 . . . . 0.0 111.41 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.657 HG13 HD21 ' A' ' 27' ' ' LEU . 4.4 tt -61.02 -37.56 77.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.19 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -78.08 -14.8 81.9 Favored Glycine 0 C--N 1.33 0.216 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.221 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.534 ' ND2' ' HA ' ' A' ' 45' ' ' ILE . 51.0 m-20 -70.74 -14.76 62.56 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -93.76 -10.31 34.67 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.454 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.7 OUTLIER 50.51 61.54 3.16 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.815 0.341 . . . . 0.0 111.412 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -127.93 161.68 28.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.164 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.69 -36.15 82.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.723 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -65.71 -9.06 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.046 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.462 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -102.99 -13.67 16.79 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.866 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 41.7 t -72.15 -38.87 64.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.439 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.503 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 26.4 tt0 -57.07 -51.51 81.15 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.624 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.508 ' HG2' HD13 ' A' ' 46' ' ' ILE . 89.6 Cg_exo -41.97 -51.64 4.5 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.261 1.974 . . . . 0.0 112.156 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.448 HD23 ' HG ' ' A' ' 77' ' ' LEU . 8.4 mp -52.69 -37.5 59.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.961 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.2 mm -56.58 -61.44 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -72.4 -10.41 59.76 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.505 ' HA ' ' HB2' ' A' ' 64' ' ' ASP . 1.8 mp -89.37 -49.39 6.73 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.615 HD13 HD22 ' A' ' 92' ' ' LEU . 11.4 mt -56.45 -15.52 4.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.851 0.358 . . . . 0.0 111.181 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -113.71 -11.82 12.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.505 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.7 OUTLIER -61.08 -46.09 92.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.056 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.591 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 14.4 t70 63.08 24.45 14.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.152 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.468 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.6 m -86.2 7.58 24.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.012 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.89 -108.47 3.52 Favored Glycine 0 C--O 1.229 -0.204 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.425 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -48.81 -30.9 6.25 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.257 0.551 . . . . 0.0 109.634 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 66' ' ' SER . 58.8 t -72.08 -50.81 34.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.783 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.591 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 38.3 ttp180 -68.2 -62.45 1.39 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.108 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.5 m -51.04 -27.67 8.52 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.957 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.435 ' HA2' ' NE1' ' A' ' 44' ' ' TRP . . . -57.84 -56.2 26.44 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.73 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.442 ' CB ' ' HA ' ' A' ' 58' ' ' LEU . . . -56.2 -46.15 79.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.854 0.359 . . . . 0.0 110.907 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.12 -27.18 63.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.775 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.414 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 27.3 ttt-85 -83.8 -34.6 24.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.814 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.463 ' HA ' HE21 ' A' ' 79' ' ' GLN . 47.5 m -61.98 -39.47 92.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.621 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.464 HD23 HG22 ' A' ' 85' ' ' VAL . 1.1 mt -59.25 -59.24 5.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.717 0.294 . . . . 0.0 111.411 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -48.93 -38.86 24.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.706 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.463 HE21 ' HA ' ' A' ' 76' ' ' SER . 41.4 mt-30 -70.81 -47.79 57.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.628 0.251 . . . . 0.0 111.37 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.581 HG21 ' HB ' ' A' ' 85' ' ' VAL . 90.0 mt -61.43 -60.63 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.36 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 53.88 70.55 0.9 Allowed Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.579 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -152.45 164.71 30.7 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.552 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -65.17 -27.64 68.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.848 0.356 . . . . 0.0 110.859 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.512 ' CD ' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -69.28 -50.99 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.875 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.581 ' HB ' HG21 ' A' ' 80' ' ' ILE . 9.9 p -70.77 -23.87 24.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.272 0.558 . . . . 0.0 110.331 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -53.46 -29.99 38.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.806 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 91' ' ' LYS . . . -65.87 -31.41 72.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.267 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.07 -51.38 69.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.968 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.552 ' HE3' ' O ' ' A' ' 104' ' ' ALA . 3.4 ppp? -69.72 -24.87 63.63 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.822 0.344 . . . . 0.0 110.387 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.432 ' N ' ' SD ' ' A' ' 89' ' ' MET . 28.2 mt-10 -68.17 -40.16 82.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.967 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 46.4 mmtm -78.78 -21.71 47.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.119 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.615 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -86.69 -30.33 21.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.786 0.327 . . . . 0.0 110.207 179.779 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.19 -26.81 67.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.975 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -80.11 -25.64 39.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.083 0.468 . . . . 0.0 110.288 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.2 p -117.4 24.42 11.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.349 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.472 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -58.24 121.68 27.04 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.153 -179.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 92.3 m -139.69 130.42 25.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.57 -0.315 . . . . 0.0 110.76 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.32 -133.8 52.6 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.759 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.54 ' O ' HG23 ' A' ' 103' ' ' VAL . 48.0 t80 -66.41 -33.78 76.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.787 0.327 . . . . 0.0 111.146 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.576 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.28 -38.69 54.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.014 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.472 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 39.9 ttt180 -70.44 -60.02 2.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.811 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -46.57 -25.2 0.65 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.155 0.503 . . . . 0.0 110.749 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 99' ' ' PHE . 37.1 t -67.7 -60.52 2.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.259 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.552 ' O ' ' HE3' ' A' ' 89' ' ' MET . . . -50.36 -59.65 3.77 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.5 t -58.4 -64.27 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -55.56 -38.34 69.21 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.42 ' HB3' ' O ' ' A' ' 103' ' ' VAL . 12.1 t80 -58.84 -48.19 82.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.867 0.365 . . . . 0.0 111.445 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -21.48 6.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.807 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -54.98 -21.3 11.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.864 0.364 . . . . 0.0 110.992 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.9 p -95.25 -49.11 5.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.146 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 73.4 m80 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.865 -179.98 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 mtt . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 120.634 0.254 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.81 14.57 1.37 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.407 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -145.37 133.01 20.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.649 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 62.45 -86.12 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.127 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -70.86 122.01 19.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.837 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.404 ' H ' ' H ' ' A' ' 7' ' ' TRP . 59.4 tptt -167.9 -18.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.404 ' H ' ' H ' ' A' ' 6' ' ' LYS . 14.8 p-90 -161.48 21.68 0.12 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.266 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 40.3 t -76.57 77.56 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.138 0.494 . . . . 0.0 111.287 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.584 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 5.3 mpt_? 51.96 20.04 1.14 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.806 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -70.21 104.68 2.7 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.9 t70 69.08 13.25 8.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.805 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.584 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 12.9 p -55.62 -26.91 20.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.042 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.6 t -168.8 -75.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.565 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.455 ' O ' ' HG3' ' A' ' 19' ' ' MET . 22.2 p -116.98 170.98 8.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.504 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -96.15 -69.5 0.75 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.414 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.2 pt? -86.26 -13.86 45.48 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.417 ' HB3' ' CB ' ' A' ' 14' ' ' THR . 31.8 t -83.33 -51.31 7.53 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -144.88 93.28 2.38 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.661 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 7.9 mtt -134.41 -4.65 2.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.906 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.69 -109.09 2.7 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.595 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -84.18 -28.34 27.43 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.943 0.402 . . . . 0.0 110.689 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -79.17 4.97 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.317 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.661 ' HB2' ' HB2' ' A' ' 19' ' ' MET . . . -99.88 -22.53 15.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.938 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.559 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -57.21 -50.83 71.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.702 -179.422 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.503 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.38 -55.71 33.25 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.634 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.503 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 87.6 Cg_exo -45.56 -27.81 3.8 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 122.093 1.862 . . . . 0.0 111.438 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 47.5 mt -71.17 -50.16 36.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.845 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.614 HD12 HD12 ' A' ' 31' ' ' LEU . 10.4 tp -73.08 -18.41 61.31 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.448 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -81.53 -39.52 24.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.389 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.5 t -66.39 -10.83 47.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.729 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.614 HD12 HD12 ' A' ' 28' ' ' LEU . 58.4 mt -63.51 -21.08 66.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.711 0.291 . . . . 0.0 111.116 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.9 p -104.52 8.77 35.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.844 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -64.65 150.37 47.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.149 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -67.86 -44.43 77.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.829 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -77.73 133.52 38.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.003 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.1 m0 -79.71 -22.44 43.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.675 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -61.99 -48.31 80.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.47 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.6 mt -75.46 -37.61 38.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.666 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.543 ' HG2' ' HA ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -61.64 -32.65 72.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.225 179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.44 -57.38 7.47 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.307 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.21 -29.18 1.48 Allowed 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 120.798 0.332 . . . . 0.0 111.287 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.67 -54.85 42.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.366 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.79 -29.29 70.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.673 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -65.29 -34.41 78.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.242 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 29.1 mt -101.05 -20.82 5.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.855 0.359 . . . . 0.0 111.599 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.568 HD13 ' HG2' ' A' ' 57' ' ' PRO . 1.3 tt -60.42 -36.89 72.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.84 -8.23 72.32 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.244 -0.979 . . . . 0.0 112.703 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -70.78 -22.75 62.34 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.568 0.21 . . . . 0.0 111.568 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -88.24 -32.86 18.32 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.722 0.268 . . . . 0.0 111.722 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.595 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 35.6 mt-30 66.22 19.04 11.06 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.593 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -86.11 169.41 13.15 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.759 0.314 . . . . 0.0 110.804 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.67 -36.82 85.52 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.613 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 32.0 ttm180 -68.05 -9.88 49.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.815 0.34 . . . . 0.0 111.066 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -104.15 4.54 34.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.165 0.507 . . . . 0.0 110.41 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.3 t -91.12 -33.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.7 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.555 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.4 tm-20 -60.21 -50.24 86.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.766 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.568 ' HG2' HD13 ' A' ' 46' ' ' ILE . 82.4 Cg_exo -46.86 -49.4 12.46 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.304 2.003 . . . . 0.0 112.471 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.516 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 6.6 mt -58.84 -28.25 65.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.716 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.8 mm -63.38 -61.3 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 64' ' ' ASP . 21.8 ttpt -72.02 -39.17 69.36 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.609 ' HG ' HG12 ' A' ' 69' ' ' VAL . 2.4 mp -55.54 -51.32 67.46 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -178.107 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.496 HD11 HD21 ' A' ' 77' ' ' LEU . 49.9 mt -62.19 -10.19 9.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.109 0.48 . . . . 0.0 110.358 -179.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -113.91 -15.06 12.41 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.025 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' A' ' 60' ' ' LYS . 10.3 t0 -61.09 -47.72 84.98 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.383 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.507 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 5.7 m-20 62.55 28.15 16.57 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.458 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.455 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 48.1 t -84.8 -16.99 39.58 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 111.089 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 113.98 -104.82 1.5 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.026 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.16 -28.26 10.63 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.46 0.648 . . . . 0.0 109.301 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.609 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.8 t -73.67 -54.99 13.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.812 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.507 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 32.7 ttp180 -66.94 -61.52 1.9 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.047 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.0 t -52.06 -31.56 30.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.933 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.34 -35.33 90.8 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.321 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.516 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -84.68 -23.43 29.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.741 0.305 . . . . 0.0 111.045 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.407 ' O ' HD12 ' A' ' 77' ' ' LEU . . . -58.51 -52.87 63.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.153 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.537 ' H ' ' HG3' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -79.44 -17.28 54.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.012 179.847 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.514 ' HB2' HH21 ' A' ' 75' ' ' ARG . 48.3 t -63.48 -45.94 88.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.886 0.374 . . . . 0.0 110.497 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.602 HD13 ' HE1' ' A' ' 89' ' ' MET . 0.4 OUTLIER -56.84 -57.44 12.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.227 179.56 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -55.21 -34.45 63.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.53 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -68.73 -23.78 64.39 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.964 0.412 . . . . 0.0 110.16 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.595 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 57.2 mt -81.95 -61.02 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.447 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 56.6 92.82 0.01 OUTLIER Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.718 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 173.26 172.13 38.51 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.595 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -63.69 -26.45 68.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.834 0.35 . . . . 0.0 110.948 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.561 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -61.78 -57.46 11.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.826 -179.684 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.478 HG21 ' HA ' ' A' ' 77' ' ' LEU . 9.9 p -70.68 -23.7 24.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.648 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.44 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 3.2 tmt_? -51.35 -33.46 29.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.375 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.18 -32.46 56.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.642 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.14 -36.5 73.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.748 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.629 ' HE2' ' HA ' ' A' ' 104' ' ' ALA . 1.6 mmm -69.8 -53.47 18.1 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.317 -0.401 . . . . 0.0 109.93 179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -54.22 -29.13 45.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.298 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -76.87 -32.08 57.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.55 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.549 HD23 ' HB2' ' A' ' 104' ' ' ALA . 1.3 tp -86.74 -29.44 22.37 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.936 0.398 . . . . 0.0 110.427 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.25 -31.77 65.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.887 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -80.16 -24.71 40.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.319 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.7 p -118.35 33.09 5.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.555 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.441 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -48.23 124.79 11.68 Favored Glycine 0 N--CA 1.449 -0.44 0 CA-C-N 114.951 -1.022 . . . . 0.0 114.085 -178.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 20.2 m -143.33 130.31 20.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.493 -0.354 . . . . 0.0 110.162 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 65.74 -142.41 43.65 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.347 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -81.6 -22.23 37.83 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.709 0.29 . . . . 0.0 110.933 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.49 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -49.92 -41.08 45.28 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.909 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.441 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 61.6 ttt180 -56.14 -60.88 2.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.739 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -54.69 -25.92 30.25 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.562 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.6 t -72.4 -50.83 32.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.742 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.629 ' HA ' ' HE2' ' A' ' 89' ' ' MET . . . -53.26 -55.53 23.76 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.8 t -60.81 -61.78 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.724 -178.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.424 ' HA ' ' OE2' ' A' ' 109' ' ' GLU . 93.8 m-20 -56.35 -36.33 68.65 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -61.91 -30.74 71.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.963 0.411 . . . . 0.0 111.232 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.5 mt -56.27 -15.95 4.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.977 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.424 ' OE2' ' HA ' ' A' ' 106' ' ' ASN . 0.5 OUTLIER -75.23 1.21 14.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.434 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 61.4 p -111.81 -61.6 1.68 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.742 0.306 . . . . 0.0 111.023 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.814 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 120.781 0.325 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.43 -87.61 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.711 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -61.54 -36.22 79.96 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.873 0.368 . . . . 0.0 110.921 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.03 -168.62 1.32 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.791 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -55.91 109.34 0.56 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.759 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -139.06 -30.26 0.74 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.523 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 70.1 m95 -98.57 114.0 26.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.905 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.587 HG13 ' HG2' ' A' ' 9' ' ' ARG . 7.7 p -164.78 -40.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.802 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.587 ' HG2' HG13 ' A' ' 8' ' ' VAL . 29.8 ptt180 -173.85 -21.48 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.622 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 91.0 mtt180 -57.71 115.02 2.55 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 12.3 t70 77.24 -49.18 0.53 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.718 0.636 . . . . 0.0 110.594 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.2 t -67.68 92.86 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.673 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.7 t -81.17 -16.93 51.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.217 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.611 ' HB ' ' HB2' ' A' ' 17' ' ' SER . 68.6 p -57.94 135.64 56.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.809 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.42 ' HB3' HD12 ' A' ' 16' ' ' LEU . . . -95.58 -67.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.046 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.503 HD12 ' N ' ' A' ' 16' ' ' LEU . 4.7 mp -82.61 -16.16 49.44 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -178.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.611 ' HB2' ' HB ' ' A' ' 14' ' ' THR . 14.8 m -70.74 -50.45 36.01 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.301 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.455 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 0.8 OUTLIER -172.05 122.48 0.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.833 0.349 . . . . 0.0 111.412 -179.491 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.549 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 63.8 mmm -133.34 -26.26 1.67 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.517 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.436 ' C ' ' H ' ' A' ' 22' ' ' GLU . . . 83.5 86.6 0.83 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.519 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 65.99 -4.99 0.58 Allowed 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 122.343 0.257 . . . . 0.0 111.536 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 19' ' ' MET . 13.0 mm-40 -103.61 -14.63 16.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.016 0.436 . . . . 0.0 110.108 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.585 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.03 -1.44 25.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.416 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 4.6 t80 -57.85 -60.19 4.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.406 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.527 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -63.51 -53.32 52.84 Favored Pre-proline 0 N--CA 1.466 0.328 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.863 -178.989 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.585 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 9.7 Cg_endo -51.56 -25.41 19.47 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 121.777 1.652 . . . . 0.0 110.513 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.624 HD21 HD13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -75.77 -40.59 55.0 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.128 178.064 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.632 HD22 ' HD3' ' A' ' 53' ' ' ARG . 6.1 tp -73.84 -20.46 60.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.137 177.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 25' ' ' GLU . 3.2 tm-20 -77.69 -40.97 39.66 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.599 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.481 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 67.7 m -61.76 -19.55 62.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.263 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.523 HD12 HD12 ' A' ' 28' ' ' LEU . 79.1 mt -66.85 -9.35 36.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.729 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.0 t -109.6 18.9 19.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.872 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.481 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 89.1 m-20 -85.36 135.12 34.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.939 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -58.56 -25.51 62.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.786 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -83.67 153.69 24.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.729 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -104.89 -25.88 12.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -63.01 -36.59 84.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.867 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.5 mt -81.19 -36.94 15.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.8 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -63.91 -31.84 73.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -56.6 -57.08 21.29 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.354 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.34 -38.82 59.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.691 0.281 . . . . 0.0 110.977 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.43 -50.62 71.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.383 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.433 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -65.24 -35.29 80.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.745 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.4 m95 -66.1 -32.13 73.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.926 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.7 mm -99.41 -23.14 4.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.624 HD13 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -54.52 -37.82 39.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -178.536 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -67.68 -19.51 71.25 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.867 -0.682 . . . . 0.0 113.769 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -70.69 -0.89 9.72 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -101.64 -26.26 13.58 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.491 ' HG2' HG23 ' A' ' 80' ' ' ILE . 57.8 mt-30 62.11 18.3 9.9 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -93.43 167.84 11.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.614 0.245 . . . . 0.0 110.692 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -62.32 -31.8 72.47 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.812 0.339 . . . . 0.0 110.684 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.632 ' HD3' HD22 ' A' ' 28' ' ' LEU . 34.4 ttm180 -69.2 -9.52 53.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.011 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.439 ' HA ' HD12 ' A' ' 46' ' ' ILE . . . -100.24 -7.54 24.54 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.207 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.4 t -91.14 -39.18 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.577 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.543 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 21.5 tt0 -60.51 -50.85 83.7 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.543 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 89.1 Cg_exo -47.8 -45.73 23.43 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.11 1.874 . . . . 0.0 112.029 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.63 HD22 ' HA ' ' A' ' 73' ' ' ALA . 4.6 mt -57.95 -31.47 66.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.639 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.407 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 50.9 mm -57.41 -61.54 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -11.75 60.79 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.684 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.3 mp -84.85 -49.63 8.24 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.715 HD13 HD22 ' A' ' 92' ' ' LEU . 8.8 mt -59.4 -10.05 2.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.17 0.51 . . . . 0.0 110.289 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 59' ' ' ILE . 8.2 pt-20 -115.42 -17.22 11.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.18 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -61.07 -32.81 72.45 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.151 0.501 . . . . 0.0 110.943 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.622 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 1.5 m-20 50.4 30.08 4.33 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.722 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.488 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 47.5 t -85.94 2.41 46.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.776 0.322 . . . . 0.0 111.094 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.28 -89.13 1.6 Allowed Glycine 0 C--O 1.228 -0.244 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.694 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -58.76 -38.55 78.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.932 0.396 . . . . 0.0 110.224 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.684 HG12 ' HG ' ' A' ' 61' ' ' LEU . 14.3 t -73.77 -49.23 36.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.233 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.622 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 45.9 ttp180 -62.48 -58.3 8.12 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.927 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 33.4 t -51.96 -26.76 11.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.771 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -60.12 -39.77 96.27 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.542 -0.837 . . . . 0.0 111.544 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.63 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -71.26 -49.96 37.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.847 0.356 . . . . 0.0 110.42 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.97 -25.69 58.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.274 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -84.16 -32.46 24.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.502 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.9 m -67.08 -44.78 79.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.008 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.555 ' HA ' HG21 ' A' ' 85' ' ' VAL . 2.5 mp -55.67 -59.64 4.56 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.513 -179.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -49.28 -36.14 19.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.714 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -66.07 -57.87 6.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.812 0.339 . . . . 0.0 111.186 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.491 HG23 ' HG2' ' A' ' 50' ' ' GLN . 92.0 mt -53.92 -60.34 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.412 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 59.73 88.45 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.41 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 175.12 172.46 40.06 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.48 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -65.91 -22.48 66.51 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.747 0.308 . . . . 0.0 111.267 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.548 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -63.37 -62.84 1.41 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.472 -179.836 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.555 HG21 ' HA ' ' A' ' 77' ' ' LEU . 3.4 p -70.85 -21.18 22.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.728 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -50.66 -46.38 58.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.376 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.32 -24.0 26.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.061 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 85' ' ' VAL . . . -71.46 -42.55 68.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.402 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.57 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -71.88 -30.82 65.8 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.446 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.7 -39.27 88.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.649 179.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -77.57 -23.0 50.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.131 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.715 HD22 HD13 ' A' ' 62' ' ' LEU . 1.2 tp -85.99 -26.98 25.14 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.34 -24.09 66.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.412 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -80.29 -26.49 38.88 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.411 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 64.3 p -117.01 20.23 13.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.556 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.488 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -53.7 121.74 19.35 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 115.095 -0.957 . . . . 0.0 113.27 -179.106 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.8 m -142.67 130.13 21.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.79 0.328 . . . . 0.0 110.835 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 57.84 -129.34 49.39 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.845 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.475 ' O ' HG23 ' A' ' 103' ' ' VAL . 57.2 t80 -70.25 -35.04 73.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.727 0.299 . . . . 0.0 111.204 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.59 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -52.0 -35.96 48.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.049 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.488 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 45.4 ttt180 -72.21 -57.27 4.38 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -48.28 -21.99 0.6 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.122 0.487 . . . . 0.0 110.762 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 99' ' ' PHE . 32.4 t -68.35 -60.4 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.645 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.587 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -54.75 -54.75 37.9 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.282 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.502 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 57.4 t -59.02 -61.38 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.586 -178.267 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -56.1 -37.92 70.05 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -58.73 -29.19 66.51 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.502 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -51.51 -28.96 14.97 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -75.22 6.78 3.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.662 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.5 m -100.22 -61.13 1.41 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.685 0.279 . . . . 0.0 111.465 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.94 -179.749 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 ttp . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.774 0.321 . . . . 0.0 110.827 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.79 -168.52 1.61 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.115 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.0 t70 63.06 -83.54 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.406 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.12 85.35 0.36 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.216 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.418 ' OD1' ' HB ' ' A' ' 8' ' ' VAL . 50.3 t-20 179.35 -63.32 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.291 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.0 tptp 65.23 -80.05 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.685 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -121.55 100.01 6.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.153 0.501 . . . . 0.0 112.324 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.576 HG22 ' HG3' ' A' ' 9' ' ' ARG . 5.5 p -101.65 138.19 26.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.85 178.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.576 ' HG3' HG22 ' A' ' 8' ' ' VAL . 72.8 mtp180 67.32 -75.41 0.06 Allowed 'General case' 0 N--CA 1.464 0.245 0 O-C-N 123.257 0.348 . . . . 0.0 110.97 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.444 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 36.9 ptt180 -48.2 161.4 0.11 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.77 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.444 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 20.5 t70 73.33 -5.65 1.92 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.521 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.494 HG12 ' H ' ' A' ' 14' ' ' THR . 99.3 t -138.04 -62.88 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.189 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.4 p 63.66 26.97 14.74 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.475 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.494 ' H ' HG12 ' A' ' 12' ' ' VAL . 30.9 p -113.01 -172.14 2.0 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.585 0.231 . . . . 0.0 110.921 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.1 -43.33 95.63 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.841 0.353 . . . . 0.0 111.293 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.666 HD13 HD21 ' A' ' 27' ' ' LEU . 13.9 mt -58.23 -43.77 87.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.549 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.553 ' HB2' ' HA ' ' A' ' 9' ' ' ARG . 83.0 p -87.0 -8.2 57.41 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.73 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 14' ' ' THR . 21.2 tpp180 -65.98 -55.74 15.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.486 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.403 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 10.3 mtp -82.38 -6.69 59.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.915 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.71 -135.8 22.29 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.906 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -67.97 -0.37 4.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.799 0.333 . . . . 0.0 111.022 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -88.95 -27.13 21.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.72 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.585 ' HB3' ' O ' ' A' ' 16' ' ' LEU . . . -87.95 5.75 39.14 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.272 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.535 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.0 t80 -61.76 -40.9 96.76 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.306 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.31 -55.56 34.97 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.469 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.508 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 65.9 Cg_exo -38.16 -29.57 0.14 Allowed 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 122.655 2.237 . . . . 0.0 112.124 178.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.666 HD21 HD13 ' A' ' 16' ' ' LEU . 28.4 mt -66.46 -58.67 4.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.39 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 31' ' ' LEU . 24.3 tp -66.74 -20.18 65.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.201 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -79.35 -34.64 41.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.849 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.53 ' HB3' HG22 ' A' ' 38' ' ' ILE . 75.6 m -65.77 -24.68 66.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.46 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 28' ' ' LEU . 82.5 mt -61.63 -12.06 14.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.791 0.329 . . . . 0.0 110.988 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.5 m -91.13 20.32 5.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.135 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -103.91 138.94 39.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.901 0.381 . . . . 0.0 111.258 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -67.75 -15.53 63.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.679 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.413 ' HB3' HD12 ' A' ' 38' ' ' ILE . 17.1 t70 -76.12 152.18 36.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.107 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 15.5 m0 -95.7 -36.14 11.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.095 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.4 ' HD2' ' O ' ' A' ' 37' ' ' ARG . 5.0 tmm_? -58.85 -38.2 78.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.187 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.53 HG22 ' HB3' ' A' ' 30' ' ' SER . 41.0 mt -75.11 -34.52 31.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.721 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -60.7 -55.85 28.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.276 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.3 -57.12 21.52 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.954 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.73 -36.24 4.87 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.766 0.317 . . . . 0.0 111.509 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.475 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.77 -53.33 57.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.044 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.32 -25.77 63.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.606 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.4 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 7.1 m95 -60.36 -42.54 95.98 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.681 0.622 . . . . 0.0 112.681 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.6 mm -99.35 -23.59 4.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.638 HD13 ' HG2' ' A' ' 57' ' ' PRO . 5.6 tt -59.87 -33.95 54.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -178.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.58 -27.13 69.21 Favored Glycine 0 CA--C 1.518 0.22 0 C-N-CA 120.707 -0.759 . . . . 0.0 113.254 -179.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -70.73 0.72 6.47 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -94.67 -27.41 15.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.66 ' HG3' ' HA ' ' A' ' 80' ' ' ILE . 14.9 mp0 62.35 26.04 15.55 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.234 0.54 . . . . 0.0 110.778 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.407 ' O ' HG23 ' A' ' 55' ' ' VAL . 2.9 m-20 -102.57 166.31 10.59 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.121 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -65.56 -34.83 79.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.16 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.525 ' HG3' HD22 ' A' ' 28' ' ' LEU . 34.2 ttm180 -67.34 -10.02 46.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.56 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -104.82 0.36 28.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.633 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 51' ' ' ASP . 57.4 t -90.69 -50.16 13.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.541 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.549 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.3 tm-20 -58.62 -49.38 93.77 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.958 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.638 ' HG2' HD13 ' A' ' 46' ' ' ILE . 72.8 Cg_exo -49.83 -27.44 15.75 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.32 2.013 . . . . 0.0 112.762 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.666 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 23.4 mt -74.23 -54.1 8.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.097 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.476 ' HA ' HD12 ' A' ' 62' ' ' LEU . 44.7 mm -49.66 -48.21 20.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.875 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -70.02 -30.16 67.4 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 -179.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.639 ' HG ' HG12 ' A' ' 69' ' ' VAL . 4.1 tp -89.82 -17.99 27.09 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.631 HD13 HD22 ' A' ' 92' ' ' LEU . 14.1 mt -70.43 -14.38 62.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.016 0.436 . . . . 0.0 110.828 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -115.12 6.75 15.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.03 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -61.11 -32.21 71.9 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.244 0.545 . . . . 0.0 110.841 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.511 ' HB2' HH21 ' A' ' 70' ' ' ARG . 18.8 t70 55.32 23.72 5.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.066 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.52 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 31.0 t -86.29 -26.01 25.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.84 0.353 . . . . 0.0 110.693 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 125.34 -109.36 1.18 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.485 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.4 ' HD1' ' NE1' ' A' ' 44' ' ' TRP . 0.1 OUTLIER -56.93 -24.33 51.72 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.253 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.639 HG12 ' HG ' ' A' ' 61' ' ' LEU . 39.9 t -68.59 -36.53 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.798 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.511 HH21 ' HB2' ' A' ' 65' ' ' ASP . 19.5 ttm180 -78.45 -51.17 10.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.726 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.1 m -58.02 -37.7 74.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.078 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.09 -51.34 50.87 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.224 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.666 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -67.34 -34.02 76.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.934 0.397 . . . . 0.0 110.703 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.528 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -55.48 -61.58 2.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.952 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -57.17 -27.71 62.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.019 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.425 ' O ' HG13 ' A' ' 80' ' ' ILE . 49.0 m -61.63 -29.92 70.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.76 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.567 HD11 HD11 ' A' ' 62' ' ' LEU . 8.3 mp -55.57 -61.34 2.41 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.711 0.291 . . . . 0.0 111.517 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.43 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 6.1 pt-20 -61.31 -24.99 66.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.997 0.427 . . . . 0.0 110.558 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -70.67 -23.95 62.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.234 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.66 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 91.6 mt -81.83 -60.38 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.571 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . 174.93 -130.94 1.85 Allowed Glycine 0 C--N 1.334 0.433 0 C-N-CA 119.962 -1.113 . . . . 0.0 113.805 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.473 ' H ' ' HD2' ' A' ' 84' ' ' ARG . . . -140.89 -72.89 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.768 -0.729 . . . . 0.0 113.623 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -60.9 -25.5 66.78 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.596 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -86.2 -50.71 6.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.675 0.274 . . . . 0.0 111.038 -179.361 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.538 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -70.84 -20.86 22.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.474 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 68.5 ttt180 -49.57 -30.4 8.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.522 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.42 -32.23 54.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.144 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.14 -51.48 37.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.941 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.511 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 4.1 ppp? -64.19 -25.68 68.18 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.548 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -70.21 -37.83 75.14 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -69.7 -28.91 66.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.476 179.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.631 HD22 HD13 ' A' ' 62' ' ' LEU . 1.4 tp -87.57 -27.53 22.51 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.961 0.41 . . . . 0.0 110.123 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.17 -30.97 71.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.253 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.466 ' HG3' HG23 ' A' ' 95' ' ' THR . 12.1 pt-20 -80.22 -22.99 41.21 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 121.088 0.47 . . . . 0.0 109.758 179.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.466 HG23 ' HG3' ' A' ' 94' ' ' GLU . 52.3 p -108.9 13.16 24.98 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.491 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.79 113.94 4.41 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 114.957 -1.019 . . . . 0.0 113.028 -179.137 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 39.4 m -140.31 130.09 24.48 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.474 -0.363 . . . . 0.0 110.868 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.69 -126.65 42.56 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.638 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.404 ' O ' HG23 ' A' ' 103' ' ' VAL . 59.5 t80 -73.52 -34.23 65.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.674 0.273 . . . . 0.0 111.263 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.468 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.63 -33.27 54.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.983 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.491 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 29.7 ttt180 -72.39 -56.07 6.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.365 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -48.72 -22.94 0.88 Allowed 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.182 0.515 . . . . 0.0 110.602 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.44 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 33.0 t -67.07 -55.04 19.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.646 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.541 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -61.97 -57.07 13.11 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.564 HG13 ' H ' ' A' ' 106' ' ' ASN . 5.2 p -59.65 -58.65 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.564 ' H ' HG13 ' A' ' 105' ' ' VAL . 4.8 t30 -56.72 -30.12 63.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.709 0.29 . . . . 0.0 111.31 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.51 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 1.2 t80 -58.96 -35.18 72.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.128 0.489 . . . . 0.0 110.308 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.8 mt -53.05 -14.37 0.6 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.898 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.01 6.23 11.95 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.7 p -121.59 -63.49 1.31 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.667 0.27 . . . . 0.0 111.506 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 23.6 p80 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 117.946 -1.026 . . . . 0.0 111.573 -179.784 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.768 0.318 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.87 20.42 8.02 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.158 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.421 ' H ' ' H ' ' A' ' 4' ' ' GLU . 17.4 t70 -165.44 -10.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.728 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.421 ' H ' ' H ' ' A' ' 3' ' ' ASP . 10.5 tp10 -86.04 -52.11 5.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.919 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -99.79 15.53 26.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.9 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -55.15 -23.91 23.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.064 0.459 . . . . 0.0 110.498 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -159.87 138.77 10.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.403 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 62.6 t -127.58 -27.23 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.277 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -143.13 -0.85 1.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 111.176 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.432 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 54.3 ttt180 -95.12 146.94 23.95 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.379 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.432 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 13.9 t70 77.81 -38.38 0.26 Allowed 'General case' 0 C--N 1.331 -0.207 0 O-C-N 123.519 0.512 . . . . 0.0 111.196 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.434 ' O ' HG13 ' A' ' 12' ' ' VAL . 7.6 p -53.99 113.03 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-O 121.299 0.571 . . . . 0.0 110.914 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.6 t -171.39 -38.07 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.125 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 24.6 p -148.06 8.28 0.84 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.135 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.48 -1.41 58.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.453 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.485 HD13 ' H ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -46.73 -22.33 0.29 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.004 -179.652 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.485 ' H ' HD13 ' A' ' 16' ' ' LEU . 54.8 m -47.61 -36.51 10.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.849 0.356 . . . . 0.0 110.488 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -176.42 94.84 0.05 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.423 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 4.8 mmt -133.39 -43.51 0.85 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.312 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 140.77 -118.24 1.37 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.403 -0.904 . . . . 0.0 112.994 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -101.82 -23.98 14.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.636 0.255 . . . . 0.0 111.341 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.479 ' HG3' ' N ' ' A' ' 23' ' ' ALA . 10.0 pt-20 -63.3 -42.31 99.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.191 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.479 ' N ' ' HG3' ' A' ' 22' ' ' GLU . . . -97.54 15.4 23.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.415 -179.493 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.452 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 2.3 t80 -63.42 -45.19 92.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.153 0.501 . . . . 0.0 110.817 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.467 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 7.2 mm-40 -63.41 -56.04 30.34 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.536 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.2 Cg_endo -55.6 -14.52 10.26 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 121.712 1.608 . . . . 0.0 110.643 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.561 HD21 HG13 ' A' ' 46' ' ' ILE . 1.4 tp -86.47 -40.26 15.48 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.373 -1.285 . . . . 0.0 109.212 178.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.586 HD12 HD12 ' A' ' 31' ' ' LEU . 31.8 tp -75.15 -22.49 58.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.297 179.093 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -69.0 -29.68 67.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.612 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 63.8 m -65.09 -27.71 68.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.41 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.586 HD12 HD12 ' A' ' 28' ' ' LEU . 40.7 mt -65.78 -11.35 45.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.172 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.0 m -100.68 16.38 25.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.645 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -88.93 145.51 25.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -67.79 -27.77 67.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.866 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -75.84 146.21 40.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.933 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 12.2 p90 -87.38 -32.91 19.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.2 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.95 -32.12 73.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.923 0.392 . . . . 0.0 110.37 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.9 mm -81.32 -41.01 18.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.294 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.456 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 40.9 ttm180 -64.06 -48.34 76.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.58 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -57.95 -49.55 73.83 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.791 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.09 -26.98 12.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.642 0.258 . . . . 0.0 111.46 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' O ' HD11 ' A' ' 27' ' ' LEU . . . -62.82 -56.69 15.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.71 0.29 . . . . 0.0 111.049 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.411 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -65.81 -28.84 69.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.049 0.452 . . . . 0.0 110.777 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.2 m95 -57.01 -39.49 74.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.481 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.8 mt -98.35 -25.73 3.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.772 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.561 HG13 HD21 ' A' ' 27' ' ' LEU . 3.5 tt -57.93 -20.99 15.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.361 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.86 -27.56 64.49 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.692 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -60.29 -30.46 69.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.715 0.293 . . . . 0.0 111.018 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -104.69 106.01 16.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.555 ' HG2' HG23 ' A' ' 80' ' ' ILE . 2.5 mt-30 -66.93 80.0 0.12 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.08 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -128.18 156.72 42.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.006 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.41 -28.58 69.35 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.927 0.394 . . . . 0.0 110.989 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -69.31 -9.52 53.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.757 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.471 ' HB2' HG12 ' A' ' 46' ' ' ILE . . . -104.85 15.4 27.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.62 -179.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 56.5 t -91.55 -58.1 3.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.118 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.485 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 17.5 tt0 -56.49 -48.87 96.29 Favored Pre-proline 0 CA--C 1.531 0.216 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.527 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 86.0 Cg_exo -42.12 -48.1 6.54 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.396 2.064 . . . . 0.0 112.527 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.61 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 7.5 mt -62.13 -44.7 96.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.065 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 50.0 mm -53.66 -58.89 2.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.192 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.46 ' HZ1' ' HB3' ' A' ' 31' ' ' LEU . 3.7 pttt -70.16 -18.93 63.22 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.017 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.717 ' HG ' HG12 ' A' ' 69' ' ' VAL . 2.9 tp -89.52 -32.71 17.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.746 HD13 HD11 ' A' ' 92' ' ' LEU . 14.2 mt -64.82 -10.49 28.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.127 0.489 . . . . 0.0 110.381 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -114.26 -2.18 13.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.113 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -61.21 -30.23 70.3 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.134 0.493 . . . . 0.0 111.055 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 54.39 27.15 7.77 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.913 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.504 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.4 t -85.0 -19.36 32.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.943 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 119.86 -110.25 1.78 Allowed Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.48 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -56.92 -26.28 58.95 Favored 'General case' 0 CA--C 1.521 -0.155 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.717 HG12 ' HG ' ' A' ' 61' ' ' LEU . 15.5 t -68.24 -34.11 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.879 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.401 ' NH1' ' HA3' ' A' ' 98' ' ' GLY . 60.1 ttp180 -78.44 -40.85 34.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.838 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 97.3 p -67.03 -38.88 86.7 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.478 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.459 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -53.33 -55.23 25.61 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.6 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.61 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -55.72 -32.72 63.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.786 0.327 . . . . 0.0 111.457 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.432 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.78 -63.89 1.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.581 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 72' ' ' GLY . 0.3 OUTLIER -53.62 -32.64 52.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.341 -179.843 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.9 t -56.2 -40.28 73.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 110.865 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.618 HD11 HD11 ' A' ' 62' ' ' LEU . 20.0 mt -62.76 -58.52 7.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -50.4 -35.62 29.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.732 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.67 -37.35 86.08 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.068 0.461 . . . . 0.0 110.148 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.555 HG23 ' HG2' ' A' ' 50' ' ' GLN . 95.1 mt -72.8 -60.27 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.792 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 59.49 98.88 0.01 OUTLIER Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.803 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.534 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 172.99 -169.73 42.88 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.617 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -72.03 -30.27 65.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.93 0.395 . . . . 0.0 110.777 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.573 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.1 OUTLIER -59.51 -50.47 73.77 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.004 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.564 HG12 HD23 ' A' ' 77' ' ' LEU . 16.5 m -70.74 -25.35 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.002 0.429 . . . . 0.0 110.739 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.439 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -55.77 -27.92 53.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.466 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.22 -34.64 32.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.755 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.08 -49.47 76.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.891 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.596 ' HE2' ' HA ' ' A' ' 104' ' ' ALA . 3.2 mmm -60.17 -46.79 88.5 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -53.3 -32.56 49.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.071 178.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -73.67 -31.37 63.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.848 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.746 HD11 HD13 ' A' ' 62' ' ' LEU . 25.6 mt -76.53 -38.65 54.76 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.85 0.357 . . . . 0.0 110.606 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.456 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -53.21 -32.45 48.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.068 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -84.82 -19.98 31.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.695 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.8 p -122.41 38.37 4.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.55 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -41.94 117.36 1.26 Allowed Glycine 0 C--N 1.334 0.434 0 CA-C-N 115.741 -0.663 . . . . 0.0 113.353 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.4 t -157.45 136.31 11.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.822 0.344 . . . . 0.0 111.091 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.401 ' HA3' ' NH1' ' A' ' 70' ' ' ARG . . . 60.16 -144.96 46.79 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.417 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -91.81 -14.55 29.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.792 0.33 . . . . 0.0 110.457 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -53.99 -35.64 62.08 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.231 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.456 ' NE ' ' HA ' ' A' ' 93' ' ' ALA . 13.9 tpt180 -67.53 -55.8 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.095 179.078 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -48.53 -28.11 3.16 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.727 178.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.2 t -78.03 -44.51 27.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.805 -1.088 . . . . 0.0 111.343 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.596 ' HA ' ' HE2' ' A' ' 89' ' ' MET . . . -54.89 -57.92 9.68 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -178.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.439 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 42.2 t -61.06 -58.59 6.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.326 -178.231 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -56.51 -42.8 78.98 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.466 ' OH ' HG21 ' A' ' 85' ' ' VAL . 43.1 t80 -62.03 -28.33 69.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.811 0.339 . . . . 0.0 111.606 -178.068 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 46.5 mt -58.08 -11.87 2.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.627 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -80.21 4.97 15.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.75 0.309 . . . . 0.0 111.07 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.2 p -140.64 -69.97 0.39 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.207 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.007 -0.996 . . . . 0.0 111.567 179.876 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.7 mtt . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.717 0.294 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.15 -15.56 1.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.183 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -110.07 -41.82 4.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.954 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -79.34 179.96 7.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.982 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.4 p30 40.07 84.58 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.025 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -165.94 -38.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.403 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.542 ' HA ' ' HE ' ' A' ' 10' ' ' ARG . 46.0 p-90 -82.81 11.58 5.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.544 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.45 ' O ' ' HB3' ' A' ' 9' ' ' ARG . 5.7 p -53.99 128.79 14.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.4 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 8' ' ' VAL . 23.7 tpt180 73.49 -41.35 0.49 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.009 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.542 ' HE ' ' HA ' ' A' ' 7' ' ' TRP . 65.3 mtm180 -56.55 127.95 33.8 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.445 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 14.6 t70 78.46 -53.72 0.48 Allowed 'General case' 0 N--CA 1.465 0.309 0 O-C-N 123.695 0.622 . . . . 0.0 111.176 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -64.73 175.96 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.624 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.4 t -156.95 -32.92 0.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.787 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.1 p -53.06 154.64 2.88 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.735 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.07 -69.37 0.72 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.516 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.3 pt? -88.43 -38.51 14.98 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.427 ' H ' HD23 ' A' ' 16' ' ' LEU . 47.3 m -53.79 -52.47 60.15 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 -178.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -144.34 105.44 4.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.931 0.396 . . . . 0.0 110.502 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.903 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -133.41 -43.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.651 -179.202 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.21 -93.84 0.87 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.651 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -128.87 2.7 5.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.666 0.27 . . . . 0.0 111.191 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -82.55 -44.71 15.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.911 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.903 ' HB3' ' HG2' ' A' ' 19' ' ' MET . . . -106.59 14.32 27.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.115 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.567 ' HA ' ' HE1' ' A' ' 19' ' ' MET . 1.0 OUTLIER -50.07 -49.78 50.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.315 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.27 -52.55 60.57 Favored Pre-proline 0 N--CA 1.466 0.374 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.822 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.494 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 71.6 Cg_exo -35.03 -34.75 0.1 Allowed 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 122.453 2.102 . . . . 0.0 112.172 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.448 HD13 ' O ' ' A' ' 23' ' ' ALA . 8.4 mp -73.79 -55.3 6.4 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.01 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -50.36 -37.46 37.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.52 178.9 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -66.62 -32.62 74.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.86 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.7 m -64.92 -13.75 57.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.117 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.471 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 87.7 mt -68.72 -19.81 64.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.897 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 56.7 m -93.36 7.64 43.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.92 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -79.92 128.1 33.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.669 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -58.88 -23.51 61.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.613 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -75.85 149.19 37.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.778 0.323 . . . . 0.0 110.565 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 38.4 p-90 -94.43 -37.95 11.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.442 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -63.69 -42.27 98.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.788 0.328 . . . . 0.0 111.036 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.6 mt -67.56 -44.61 86.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.867 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.471 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.4 ttm180 -63.31 -23.48 67.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.576 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.33 -61.0 6.07 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.48 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.14 -36.31 8.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.733 0.301 . . . . 0.0 111.402 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.418 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.56 -54.71 39.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.906 0.384 . . . . 0.0 110.861 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.4 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -64.8 -30.5 71.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.327 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.3 m95 -70.8 -31.2 67.88 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 61.7 mt -99.6 -27.02 3.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.873 0.368 . . . . 0.0 111.648 -178.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.683 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.1 tt -60.85 -28.88 44.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.699 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.543 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -69.89 -4.06 46.13 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.937 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -69.82 -40.22 76.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.755 0.312 . . . . 0.0 110.196 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.465 ' C ' ' H ' ' A' ' 51' ' ' ASP . 11.9 m-85 -91.33 119.42 31.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.738 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.459 ' HA ' HD12 ' A' ' 80' ' ' ILE . 1.9 mt-30 -72.78 25.85 0.06 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.48 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.465 ' H ' ' C ' ' A' ' 49' ' ' PHE . 29.2 t70 -83.98 155.33 22.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.908 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -59.07 -33.0 70.29 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.329 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -67.63 -11.96 59.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.865 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.641 ' O ' HD13 ' A' ' 58' ' ' LEU . . . -105.91 -8.45 17.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.036 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 59' ' ' ILE . 96.4 t -91.52 -30.16 4.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.418 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.557 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 17.3 tt0 -60.27 -50.52 85.57 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.683 ' HG2' HD13 ' A' ' 46' ' ' ILE . 74.5 Cg_exo -49.32 -52.37 8.91 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.924 1.75 . . . . 0.0 111.859 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.687 HD23 ' HG ' ' A' ' 77' ' ' LEU . 5.1 mp -56.04 -27.17 52.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.881 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 55' ' ' VAL . 40.4 mm -63.35 -59.54 4.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.739 0.304 . . . . 0.0 111.379 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -70.04 -22.79 63.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.521 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.747 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -65.37 -51.94 57.04 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.941 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.772 HD13 HD22 ' A' ' 92' ' ' LEU . 9.1 mt -51.93 -21.58 3.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.351 . . . . 0.0 111.304 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -104.24 -18.36 14.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.107 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.414 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 8.3 t0 -59.65 -36.06 75.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 111.144 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.482 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 24.7 t70 52.19 30.28 7.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.229 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.488 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.3 t -80.07 -3.07 47.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.217 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.87 -81.56 1.6 Allowed Glycine 0 C--O 1.228 -0.238 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.944 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.64 -47.15 82.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.2 0.524 . . . . 0.0 109.649 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.747 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.2 t -69.04 -45.44 80.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.46 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.482 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 7.0 tmm_? -64.32 -62.45 1.6 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.873 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.7 m -54.07 -30.14 47.01 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.975 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.72 -39.85 94.13 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.41 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.403 ' HA ' ' HG ' ' A' ' 58' ' ' LEU . . . -67.9 -38.85 83.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.638 0.256 . . . . 0.0 111.363 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.63 -54.23 24.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.3 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.436 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 4.0 ptp180 -67.96 -42.94 80.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.002 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.543 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 74.6 m -59.21 -31.06 68.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.742 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.695 HD22 HG13 ' A' ' 85' ' ' VAL . 69.6 mt -70.67 -60.46 2.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.975 -179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -59.87 -22.51 62.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.147 0.499 . . . . 0.0 110.293 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.436 ' HB2' ' O ' ' A' ' 75' ' ' ARG . 41.2 tt0 -56.9 -37.49 71.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.56 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.459 HD12 ' HA ' ' A' ' 50' ' ' GLN . 32.2 mm -71.56 -60.22 2.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.963 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.44 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 69.45 80.31 0.26 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.296 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -176.69 179.1 47.85 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.391 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -63.44 -22.39 66.86 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.823 0.345 . . . . 0.0 110.971 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.56 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -62.07 -59.88 4.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.355 -179.598 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.695 HG13 HD22 ' A' ' 77' ' ' LEU . 74.8 t -69.64 -24.09 26.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.94 0.4 . . . . 0.0 110.638 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.427 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 2.7 tmt_? -56.65 -27.44 58.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.072 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -82.67 -31.8 28.46 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.769 0.319 . . . . 0.0 111.079 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.79 -34.51 75.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.422 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.57 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 7.0 mmt -71.17 -47.57 56.91 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.414 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -57.74 -29.85 65.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.031 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -80.07 -32.7 39.29 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.935 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.772 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -80.81 -26.08 37.37 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.022 0.439 . . . . 0.0 109.847 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.02 -21.67 65.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.526 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -80.22 -27.21 38.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.675 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.1 p -118.44 24.27 11.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.387 178.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.43 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -56.85 119.65 16.59 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.549 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.4 t -144.58 130.4 19.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.836 0.351 . . . . 0.0 110.894 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.44 -130.08 11.84 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.824 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -87.0 -26.51 23.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.571 0.225 . . . . 0.0 111.267 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.652 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.42 -37.49 62.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.859 0.362 . . . . 0.0 111.5 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.43 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 35.4 ttp180 -66.56 -58.46 5.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.707 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 57.9 tttp -46.23 -24.31 0.45 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.191 0.52 . . . . 0.0 110.79 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 45.2 t -71.93 -59.74 3.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.634 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.738 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -56.34 -51.79 66.95 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 15.5 t -62.27 -63.74 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -55.36 -39.3 69.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.57 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 31.0 t80 -61.57 -31.73 71.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 120.808 0.337 . . . . 0.0 111.441 -178.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 58.5 mt -57.38 -12.19 2.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.61 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.86 -12.2 60.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.865 0.364 . . . . 0.0 110.993 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 73.0 p -113.7 -62.62 1.57 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.309 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.152 -0.927 . . . . 0.0 110.805 -179.971 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.752 0.311 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 62.42 14.47 6.94 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.305 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -111.54 -49.22 3.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.823 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -89.4 -40.46 12.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.985 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -80.21 99.51 7.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.101 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HG3' HH21 ' A' ' 10' ' ' ARG . 61.4 tttm -173.43 -46.47 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.67 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.3 p-90 -97.0 11.96 34.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.87 -38.16 79.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.023 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 74.2 mtt180 -110.92 -65.68 1.15 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.589 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.535 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 80.2 mtm180 -52.96 152.72 3.82 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.535 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 6.4 m-20 78.1 -38.6 0.25 Allowed 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.522 0.514 . . . . 0.0 111.758 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 52.4 t -68.9 -76.9 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.548 0.213 . . . . 0.0 111.319 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.2 t -169.57 178.04 4.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.974 0.416 . . . . 0.0 111.282 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.561 ' HB ' ' HA ' ' A' ' 18' ' ' ARG . 47.7 p -126.88 119.57 27.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.481 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.95 ' HB3' ' HB3' ' A' ' 23' ' ' ALA . . . -95.67 -73.94 0.57 Allowed 'General case' 0 C--O 1.231 0.13 0 C-N-CA 120.203 -0.599 . . . . 0.0 112.203 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.5 tp -91.28 -69.71 0.72 Allowed 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.398 -0.521 . . . . 0.0 111.347 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 59.3 p -92.66 -52.91 4.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.01 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.561 ' HA ' ' HB ' ' A' ' 14' ' ' THR . 32.4 ttm180 175.9 28.32 0.0 OUTLIER 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.185 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.587 ' HB3' ' HB3' ' A' ' 22' ' ' GLU . 1.5 mtp -89.62 -44.23 10.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.101 -178.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.728 ' H ' ' H ' ' A' ' 15' ' ' ALA . . . 83.95 -85.88 1.53 Allowed Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.555 -0.831 . . . . 0.0 113.096 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.76 2.31 55.5 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.587 ' HB3' ' HB3' ' A' ' 19' ' ' MET . 9.9 tp10 -106.55 -22.91 12.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.82 0.343 . . . . 0.0 110.935 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.95 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . . . -96.63 3.12 52.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.181 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.4 t80 -60.61 -48.59 81.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.969 0.414 . . . . 0.0 110.243 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.406 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 18.9 mt-10 -63.45 -56.99 22.03 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.965 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.509 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 88.0 Cg_exo -43.04 -28.82 1.38 Allowed 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.365 2.043 . . . . 0.0 111.624 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 65.3 mt -68.76 -55.02 12.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.298 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.554 HD12 HD12 ' A' ' 31' ' ' LEU . 18.7 tp -67.88 -18.82 64.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.513 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -79.04 -42.8 25.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.964 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.1 p -66.48 -13.7 61.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.395 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.554 HD12 HD12 ' A' ' 28' ' ' LEU . 87.3 mt -67.51 -7.4 25.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.244 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.8 p -95.7 15.33 20.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.561 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -95.01 136.93 34.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -67.3 -1.87 5.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.025 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -84.59 153.24 23.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.77 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.4 p-90 -104.43 -38.64 6.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.954 0.407 . . . . 0.0 110.53 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.454 ' HG3' HG13 ' A' ' 38' ' ' ILE . 13.7 ptm180 -62.82 -39.03 93.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.79 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.454 HG13 ' HG3' ' A' ' 37' ' ' ARG . 50.8 mt -79.36 -47.99 21.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.934 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.488 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 38.3 ttm180 -63.5 -28.51 70.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.601 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.69 -59.02 6.37 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.423 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.14 -29.63 22.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.741 0.305 . . . . 0.0 110.976 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.67 -55.49 23.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.479 ' O ' HG22 ' A' ' 46' ' ' ILE . . . -69.48 -22.89 63.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.193 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.1 m95 -66.12 -28.31 68.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.614 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.8 mt -99.6 -23.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.71 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.479 HG22 ' O ' ' A' ' 43' ' ' ALA . 0.6 OUTLIER -61.08 -32.69 53.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.503 -179.248 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.62 -16.58 63.52 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.552 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.97 -27.04 65.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.837 0.351 . . . . 0.0 110.681 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -99.05 112.77 24.81 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.801 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -77.98 36.58 0.23 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.817 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.416 ' O ' HG23 ' A' ' 55' ' ' VAL . 33.9 t70 -95.37 165.53 12.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.992 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.48 -31.31 72.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.518 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.444 ' HB3' ' CE2' ' A' ' 24' ' ' PHE . 41.5 ttm180 -69.17 -14.15 62.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.425 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.37 5.19 31.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.031 0.444 . . . . 0.0 110.641 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.651 ' HA ' ' NH2' ' A' ' 84' ' ' ARG . 98.9 t -87.03 -46.9 16.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.804 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.466 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 34.2 tt0 -60.34 -48.25 94.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.466 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 81.0 Cg_exo -42.14 -52.09 4.36 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.405 2.07 . . . . 0.0 112.817 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 73' ' ' ALA . 6.8 mt -60.62 -37.0 79.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.333 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.9 mm -55.21 -59.43 2.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.477 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.19 -15.77 62.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.24 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.788 HD23 ' H ' ' A' ' 73' ' ' ALA . 0.4 OUTLIER -74.14 -52.66 11.85 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -178.892 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.52 HD13 HD22 ' A' ' 92' ' ' LEU . 7.9 mt -57.06 -10.34 1.12 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.306 -179.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -111.99 -13.44 13.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.618 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.413 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 52.8 m-20 -61.14 -32.23 71.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.799 0.333 . . . . 0.0 111.78 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.511 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 32.9 m-20 48.26 32.12 2.98 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.07 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.47 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 29.3 t -83.07 -24.42 32.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.494 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.43 -85.39 0.39 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.95 -0.643 . . . . 0.0 111.556 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.89 -42.43 99.77 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.679 HG12 ' HG ' ' A' ' 61' ' ' LEU . 13.6 t -69.33 -56.86 10.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.056 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.511 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 7.3 tmm_? -54.67 -51.65 64.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.544 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.6 m -63.96 -19.92 65.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.377 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.49 -65.12 3.65 Favored Glycine 0 C--O 1.228 -0.222 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.572 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.788 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -49.77 -31.23 11.06 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.63 -46.54 73.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.788 0.328 . . . . 0.0 111.35 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 6.8 ptp180 -82.23 -24.45 34.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.853 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.405 ' HA ' ' OE1' ' A' ' 79' ' ' GLN . 49.6 m -63.52 -38.94 93.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.512 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.6 mt -58.92 -59.96 4.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.137 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.458 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 38.8 mt-10 -46.23 -32.67 3.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.132 179.035 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 96.1 mt-30 -70.81 -41.5 71.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.348 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.499 HD13 ' HE ' ' A' ' 84' ' ' ARG . 59.9 mt -75.28 -61.43 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.86 -179.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.64 168.51 2.36 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.673 -0.775 . . . . 0.0 113.006 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.58 -170.59 24.4 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.895 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -64.89 -24.48 67.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.156 0.503 . . . . 0.0 110.419 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.651 ' NH2' ' HA ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER -54.83 -62.37 1.7 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.63 179.719 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.528 HG21 ' OH ' ' A' ' 107' ' ' TYR . 16.1 m -63.22 -24.75 36.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.27 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.534 ' HA ' ' HE1' ' A' ' 89' ' ' MET . 0.2 OUTLIER -54.62 -33.36 60.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.366 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.21 -24.27 24.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.713 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.43 ' HB2' ' NH1' ' A' ' 84' ' ' ARG . . . -70.27 -49.06 53.72 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.534 ' HE1' ' HA ' ' A' ' 86' ' ' ARG . 0.7 OUTLIER -70.18 -30.51 67.65 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.639 0.257 . . . . 0.0 110.888 -179.14 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -69.8 -43.4 72.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.7 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -67.91 -28.99 67.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.716 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.52 HD22 HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -86.33 -27.84 24.06 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.999 179.702 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.9 -22.91 65.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.578 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -80.23 -26.67 38.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.494 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 59.8 p -122.65 23.58 9.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.374 0.606 . . . . 0.0 109.471 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.559 ' HA3' ' HG2' ' A' ' 101' ' ' ARG . . . -58.31 124.94 38.02 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 115.036 -0.984 . . . . 0.0 113.128 -179.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.412 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 2.3 t -141.23 130.15 23.13 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.72 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 62.63 -140.18 45.85 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.406 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.483 ' O ' HG23 ' A' ' 103' ' ' VAL . 62.2 t80 -62.07 -35.5 78.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.758 0.313 . . . . 0.0 110.66 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.504 ' HB2' ' HD3' ' A' ' 70' ' ' ARG . . . -54.44 -36.53 64.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.253 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.559 ' HG2' ' HA3' ' A' ' 96' ' ' GLY . 1.3 tmt_? -68.83 -61.78 1.66 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.466 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -52.11 -22.53 4.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.295 -179.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 99' ' ' PHE . 5.1 t -67.07 -53.15 36.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.536 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.453 ' O ' HD23 ' A' ' 108' ' ' LEU . . . -54.81 -62.61 1.54 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.068 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.5 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 23.5 t -54.78 -57.67 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.397 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.14 -32.5 66.43 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.528 ' OH ' HG21 ' A' ' 85' ' ' VAL . 34.9 t80 -63.3 -25.35 68.27 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 120.759 0.314 . . . . 0.0 111.161 -178.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.8 mm? -50.91 -26.89 6.46 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.01 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -53.91 -13.58 0.79 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.36 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 34.7 p -119.75 -87.49 0.64 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.305 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.418 ' HB2' HG21 ' A' ' 85' ' ' VAL . 15.7 m-70 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.952 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.0 mmt . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.78 0.324 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.72 -36.72 18.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.372 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -75.6 167.69 21.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.139 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -90.1 51.63 2.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.086 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.6 p30 41.53 84.32 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.779 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -128.13 -18.9 4.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.577 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -117.08 51.36 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.835 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.443 ' O ' HG21 ' A' ' 12' ' ' VAL . 8.8 p -166.98 -24.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.409 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -119.45 -30.42 4.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.919 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.475 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 46.3 ttt180 -59.82 135.05 57.57 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.475 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 20.6 t70 75.03 -20.9 0.32 Allowed 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.399 0.437 . . . . 0.0 111.544 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.482 HG13 ' HA ' ' A' ' 19' ' ' MET . 74.1 t -66.16 -73.16 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.342 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.8 t 62.9 -83.09 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.023 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.6 p -59.64 169.64 1.29 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.805 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.417 ' O ' ' HB3' ' A' ' 19' ' ' MET . . . -95.88 -69.83 0.74 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.525 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.2 pt? -87.68 -26.6 22.9 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.7 t -59.05 -51.85 68.27 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.949 0.404 . . . . 0.0 110.504 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.624 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 3.2 mmp_? -148.21 112.98 5.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.987 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.641 ' HB2' ' HB3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -133.46 -44.41 0.83 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.797 -178.961 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.49 ' N ' ' HG2' ' A' ' 19' ' ' MET . . . 62.6 84.66 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.909 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.491 ' H ' ' HE2' ' A' ' 49' ' ' PHE . 19.0 t70 67.43 9.02 6.71 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.641 ' HB3' ' HB2' ' A' ' 19' ' ' MET . 12.6 tp10 -103.98 -45.09 4.85 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.186 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.573 ' HB3' ' HG3' ' A' ' 19' ' ' MET . . . -107.02 17.86 22.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.895 0.378 . . . . 0.0 110.91 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 51' ' ' ASP . 0.4 OUTLIER -52.62 -48.27 66.47 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.021 179.464 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.526 ' HG3' ' NH1' ' A' ' 53' ' ' ARG . 3.6 mt-10 -62.21 -57.02 25.68 Favored Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 1.9 Cg_endo -50.72 -19.18 4.85 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.996 1.797 . . . . 0.0 111.498 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.505 HD21 ' HA ' ' A' ' 46' ' ' ILE . 0.8 OUTLIER -81.63 -39.91 23.72 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.697 179.367 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 31' ' ' LEU . 10.8 tp -80.26 -22.15 41.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.364 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -73.95 -34.63 64.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.626 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.0 m -66.17 -17.19 64.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.12 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 28' ' ' LEU . 51.3 mt -68.23 -6.59 24.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.862 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.1 m -103.19 11.24 37.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.758 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -71.1 142.15 50.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.821 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -59.51 -34.53 72.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.346 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -81.4 144.33 31.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.973 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.1 p90 -87.3 -32.8 19.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.016 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -58.77 -35.62 73.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.468 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.2 mm -80.83 -41.4 19.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.492 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.531 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 29.5 ttm180 -63.26 -20.02 65.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.629 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.81 -62.88 3.58 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.707 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.62 -33.04 2.64 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.644 0.259 . . . . 0.0 111.438 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.438 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.02 -52.75 63.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.916 0.389 . . . . 0.0 110.085 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.496 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -64.47 -28.71 69.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.74 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -66.97 -36.69 82.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.124 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.1 mm -99.29 -22.29 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.505 ' HA ' HD21 ' A' ' 27' ' ' LEU . 4.2 tt -61.04 -38.94 80.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -178.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.75 -6.59 17.87 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.256 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -70.59 -49.77 44.22 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.491 ' HE2' ' H ' ' A' ' 21' ' ' ASP . 41.3 m-85 -65.69 -26.81 67.94 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.508 ' HG2' HG12 ' A' ' 80' ' ' ILE . 2.0 mt-30 61.07 16.29 6.97 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.783 0.325 . . . . 0.0 111.4 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 55' ' ' VAL . 18.9 t70 -84.11 -178.72 7.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.033 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -61.54 -37.24 83.06 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -179.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.609 ' HB3' HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -67.19 -10.6 52.14 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.888 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.98 -9.42 17.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.975 0.417 . . . . 0.0 111.273 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 51' ' ' ASP . 62.5 t -82.02 -47.88 18.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.934 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.481 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 4.7 tp10 -60.1 -48.31 94.76 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.5 ' HG2' HD13 ' A' ' 46' ' ' ILE . 83.9 Cg_exo -43.0 -53.07 4.26 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.289 1.993 . . . . 0.0 112.664 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.613 HD13 HD22 ' A' ' 77' ' ' LEU . 16.3 mt -53.54 -34.22 57.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.046 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 42.9 mm -63.29 -61.15 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.503 ' HG3' HD13 ' A' ' 61' ' ' LEU . 16.8 pttt -72.19 -19.09 61.8 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.675 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -77.77 -51.1 11.07 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.617 HD11 HD21 ' A' ' 77' ' ' LEU . 69.4 mt -63.43 -9.01 10.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.225 0.536 . . . . 0.0 109.972 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -112.94 -16.23 12.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.478 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.459 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.9 OUTLIER -61.09 -54.44 44.61 Favored 'General case' 0 CA--C 1.517 -0.288 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.307 -179.571 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 12.5 t70 72.02 25.5 3.02 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.738 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 69.0 m -81.21 -4.92 57.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.993 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.53 -101.84 2.45 Favored Glycine 0 C--O 1.229 -0.193 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.656 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.16 -30.46 37.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.262 0.553 . . . . 0.0 109.928 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.675 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.0 t -73.6 -46.83 46.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.198 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -70.46 -60.51 2.22 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.686 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.6 m -54.16 -28.34 39.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.872 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.88 -37.74 94.85 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.447 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.421 ' O ' HD23 ' A' ' 77' ' ' LEU . . . -79.8 -37.08 36.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.653 0.263 . . . . 0.0 110.987 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -46.26 -35.06 4.89 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.157 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.416 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 1.2 ptp85 -83.91 -33.51 24.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.652 0.263 . . . . 0.0 111.453 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.4 m -57.84 -37.43 73.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.891 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.617 HD21 HD11 ' A' ' 62' ' ' LEU . 4.1 mm? -55.33 -61.22 2.48 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 110.95 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -65.25 -24.69 67.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.677 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 75' ' ' ARG . 10.8 tt0 -60.89 -58.49 8.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.8 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.607 HD12 HG13 ' A' ' 85' ' ' VAL . 95.4 mt -63.29 -52.02 63.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.101 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 55.39 76.43 0.19 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.663 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -174.68 -179.76 45.48 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.598 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -59.64 -21.48 60.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.951 0.405 . . . . 0.0 110.699 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.612 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 1.2 mpt_? -59.7 -64.33 0.98 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.333 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.607 HG13 HD12 ' A' ' 80' ' ' ILE . 0.0 OUTLIER -70.84 -20.59 22.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.931 179.351 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -52.88 -33.09 48.42 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.933 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.55 -26.34 35.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.441 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.17 -45.0 64.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.008 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.556 ' HE3' ' HG2' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -68.88 -29.77 68.13 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.488 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.556 ' HG2' ' HE3' ' A' ' 89' ' ' MET . 10.1 mm-40 -70.82 -31.32 68.01 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.077 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -74.45 -31.4 62.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.191 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.56 HD21 ' O ' ' A' ' 100' ' ' ALA . 1.7 tp -86.55 -32.23 20.81 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.776 0.322 . . . . 0.0 110.172 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -54.91 -28.06 47.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.162 0.506 . . . . 0.0 110.265 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -83.21 -25.46 31.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.205 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 54.2 p -116.12 32.08 6.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.008 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.565 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -46.51 121.41 5.66 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.307 -0.86 . . . . 0.0 113.771 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.0 m -150.47 130.71 13.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.777 0.322 . . . . 0.0 110.403 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.9 -139.72 28.97 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.348 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -89.6 -18.48 26.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.824 0.345 . . . . 0.0 110.367 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.604 ' HB1' ' HB3' ' A' ' 62' ' ' LEU . . . -54.18 -43.96 71.14 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.594 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.565 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 55.4 ttp180 -51.84 -57.95 7.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.31 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -56.55 -32.15 64.86 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.094 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.56 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 18.9 t -64.14 -41.83 93.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.227 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.516 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -64.51 -57.18 9.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.056 0.455 . . . . 0.0 111.872 -179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.523 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 6.3 p -64.93 -54.26 31.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.879 -178.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.516 ' N ' HG13 ' A' ' 105' ' ' VAL . 5.1 t30 -55.55 -34.36 64.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.588 0.232 . . . . 0.0 111.404 -179.123 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.449 ' OH ' HG23 ' A' ' 85' ' ' VAL . 5.6 t80 -58.83 -31.68 68.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.46 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.523 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -49.96 -20.29 0.89 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.53 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -69.08 5.06 1.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.449 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.8 m -108.48 -72.51 0.72 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.711 0.291 . . . . 0.0 111.329 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 84.4 t60 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.735 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.7 tpt . . . . . 0 N--CA 1.484 1.247 0 CA-C-O 120.851 0.358 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -126.34 26.67 6.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.059 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.7 t70 64.47 9.16 4.79 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.861 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -98.83 -47.92 5.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.729 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -104.86 111.68 24.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.782 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 53.7 mttm -104.32 -43.43 5.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.82 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -97.62 111.84 23.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.4 p -175.94 -24.94 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.282 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -105.56 1.33 27.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.14 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' C ' ' H ' ' A' ' 12' ' ' VAL . 25.4 ptt180 -51.66 105.7 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.48 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.401 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 13.5 t70 74.81 -26.75 0.19 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.26 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.531 HG12 ' HB2' ' A' ' 17' ' ' SER . 7.0 t -68.09 158.92 5.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.021 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.541 ' O ' HG22 ' A' ' 14' ' ' THR . 6.7 t -157.59 -156.44 0.58 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.809 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.614 HG23 ' H ' ' A' ' 16' ' ' LEU . 3.2 t 49.08 -170.55 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.044 -0.525 . . . . 0.0 112.093 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.464 ' O ' ' HG2' ' A' ' 18' ' ' ARG . . . -56.99 -41.25 78.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.979 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.614 ' H ' HG23 ' A' ' 14' ' ' THR . 2.7 tm? -49.57 -28.58 5.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.743 0.306 . . . . 0.0 111.041 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.531 ' HB2' HG12 ' A' ' 12' ' ' VAL . 28.0 t -87.18 -27.73 22.85 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 20.9 ptt180 -52.67 -27.27 16.61 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.567 0.222 . . . . 0.0 111.401 -179.132 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.733 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 72.1 mmm -121.75 -27.32 4.7 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.905 0.383 . . . . 0.0 110.302 178.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 84.6 -122.49 5.9 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.461 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -66.02 -24.69 66.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.847 0.356 . . . . 0.0 110.484 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -77.82 -13.06 60.01 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.733 ' HB2' ' HB2' ' A' ' 19' ' ' MET . . . -94.83 2.57 55.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.619 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.3 t80 -62.26 -40.43 96.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 121.315 0.578 . . . . 0.0 109.526 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.513 ' HG2' ' NH1' ' A' ' 53' ' ' ARG . 43.2 mt-10 -63.41 -56.2 28.92 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.881 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.586 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 77.2 Cg_exo -37.2 -29.23 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.24 0 C-N-CA 122.639 2.226 . . . . 0.0 111.695 179.026 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 81.7 mt -72.68 -58.41 3.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.588 178.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.544 ' HA ' HD12 ' A' ' 31' ' ' LEU . 49.1 tp -61.27 -24.88 66.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.783 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -79.1 -44.6 21.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.765 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.5 p -65.54 -11.73 46.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.0 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.547 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 43.5 mt -70.21 -6.84 37.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.129 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 77.7 p -111.98 13.89 20.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.776 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -69.09 147.67 51.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.017 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -56.82 -44.12 81.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.395 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -75.85 163.27 27.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.055 0.455 . . . . 0.0 111.388 -179.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -103.72 -29.59 10.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.737 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -63.53 -32.97 74.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.218 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.3 mt -81.16 -41.8 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.847 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.547 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 32.7 ttm180 -61.75 -29.8 70.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.724 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -56.11 -63.25 5.48 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.348 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.27 -29.28 9.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.545 0.212 . . . . 0.0 111.479 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.56 -52.08 59.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.873 0.368 . . . . 0.0 110.531 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.431 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -67.01 -31.35 71.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.687 179.248 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -70.7 -28.29 64.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.254 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 81.2 mt -98.76 -27.99 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.841 0.353 . . . . 0.0 111.655 -179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.594 HD13 ' HG2' ' A' ' 57' ' ' PRO . 1.5 tt -60.31 -30.36 46.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.827 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.42 -20.8 63.81 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.939 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.8 m-20 -65.79 -23.85 66.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.846 0.355 . . . . 0.0 110.445 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.489 ' C ' ' H ' ' A' ' 51' ' ' ASP . 9.1 m-85 -95.29 109.5 21.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.486 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -71.85 16.66 0.11 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.3 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.489 ' H ' ' C ' ' A' ' 49' ' ' PHE . 37.1 t70 -84.04 161.56 20.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.641 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.91 -28.7 69.13 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.552 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.513 ' NH1' ' HG2' ' A' ' 25' ' ' GLU . 12.7 ttm180 -63.91 -13.95 49.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.024 0.44 . . . . 0.0 110.489 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.19 -10.61 16.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.486 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.429 HG13 ' HB2' ' A' ' 88' ' ' ALA . 68.2 t -82.23 -36.11 13.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.625 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.559 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 3.8 tp10 -60.37 -49.97 87.96 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.274 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.594 ' HG2' HD13 ' A' ' 46' ' ' ILE . 82.8 Cg_exo -45.14 -51.27 7.89 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.287 1.991 . . . . 0.0 111.892 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.754 HD13 HD22 ' A' ' 77' ' ' LEU . 4.8 mt -54.73 -35.04 63.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.624 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.558 HG23 ' HD2' ' A' ' 91' ' ' LYS . 46.2 mm -60.77 -60.76 2.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.822 0.344 . . . . 0.0 111.566 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -71.48 -10.85 60.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.103 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.75 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.7 mp -88.62 -48.05 7.83 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.692 HD13 HD22 ' A' ' 92' ' ' LEU . 26.5 mt -60.32 -12.31 8.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.971 0.415 . . . . 0.0 110.798 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -113.93 -11.97 12.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.816 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -61.12 -44.95 96.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.101 0.477 . . . . 0.0 111.089 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.63 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 28.5 m-20 66.93 22.22 10.17 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.944 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.513 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 39.6 m -86.38 16.06 4.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.637 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.08 -100.27 0.84 Allowed Glycine 0 C--O 1.227 -0.319 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.857 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -46.86 -40.97 14.97 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.076 0.465 . . . . 0.0 110.741 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.75 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.4 t -71.26 -51.11 36.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.45 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.63 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 53.7 ttp180 -62.3 -60.64 3.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.22 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 88.5 p -53.98 -34.13 58.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.993 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.48 -26.71 57.31 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.056 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.5 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -88.12 -39.77 14.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.787 0.327 . . . . 0.0 110.878 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.07 -34.99 59.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.099 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -80.66 -23.97 39.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.937 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.6 m -67.07 -39.07 86.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.291 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.754 HD22 HD13 ' A' ' 58' ' ' LEU . 4.2 mm? -55.36 -57.02 13.58 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.826 0.345 . . . . 0.0 110.565 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.91 -34.75 78.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.363 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -56.37 -44.61 80.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.254 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.409 HD12 ' CG1' ' A' ' 85' ' ' VAL . 92.2 mt -78.22 -59.73 2.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.853 0.359 . . . . 0.0 110.752 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.61 97.77 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.599 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.437 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 170.16 -177.48 43.44 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.484 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -68.83 -30.97 69.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.572 0.225 . . . . 0.0 110.972 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.538 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.57 -53.22 60.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.821 0.343 . . . . 0.0 110.438 179.732 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.538 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -70.82 -24.07 24.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.267 179.311 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.444 HH11 ' HD2' ' A' ' 86' ' ' ARG . 18.1 ttt180 -58.84 -38.09 77.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.419 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.32 -22.86 59.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.757 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.429 ' HB2' HG13 ' A' ' 55' ' ' VAL . . . -71.52 -46.83 58.54 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.993 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.603 ' HE2' ' HB3' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -72.23 -32.69 66.94 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.6 179.701 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.534 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 27.1 mt-10 -59.16 -41.46 88.44 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 179.121 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.558 ' HD2' HG23 ' A' ' 59' ' ' ILE . 9.3 tmtm? -64.49 -23.6 67.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.636 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.692 HD22 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -87.1 -28.37 22.56 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.881 179.223 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.26 -30.97 72.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.317 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.476 ' HG3' HG23 ' A' ' 95' ' ' THR . 13.5 pt-20 -80.15 -18.63 49.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.967 0.413 . . . . 0.0 110.366 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.476 HG23 ' HG3' ' A' ' 94' ' ' GLU . 51.2 p -123.98 25.53 7.9 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.008 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -65.89 127.01 30.12 Favored Glycine 0 N--CA 1.443 -0.871 0 CA-C-N 115.011 -0.995 . . . . 0.0 113.343 -178.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.1 t -141.92 131.83 24.44 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.27 -0.465 . . . . 0.0 111.138 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.02 -127.13 42.33 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.821 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -66.46 -40.02 89.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.596 0.236 . . . . 0.0 111.058 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.53 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -50.67 -41.17 55.25 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.605 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.424 ' CD ' ' HA3' ' A' ' 96' ' ' GLY . 7.9 tpt180 -64.33 -59.11 4.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.092 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -50.02 -23.27 1.95 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.146 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.53 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 13.6 t -66.45 -60.27 2.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.587 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.26 -53.23 60.41 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.169 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.524 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 10.2 p -60.79 -50.07 82.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.52 ' N ' HG13 ' A' ' 105' ' ' VAL . 58.1 t30 -70.75 -30.67 67.25 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.439 ' HD2' ' HG2' ' A' ' 89' ' ' MET . 7.4 t80 -64.56 -49.07 72.67 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -177.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.603 ' HB3' ' HE2' ' A' ' 89' ' ' MET . 3.8 pp -55.03 -12.14 0.8 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.238 -178.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -65.87 -30.27 70.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.917 0.389 . . . . 0.0 110.692 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 22.0 p -112.61 -42.24 3.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.161 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 29.9 p80 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.529 -0.748 . . . . 0.0 111.488 179.74 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 ptp . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.89 0.376 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.11 -58.3 2.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.124 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -104.76 106.51 17.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.989 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 57.37 -168.22 0.12 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.181 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -91.39 67.32 5.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.894 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.441 ' C ' ' H ' ' A' ' 8' ' ' VAL . 31.6 mmmt -110.19 159.05 17.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.491 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 68.18 -7.49 0.65 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.862 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.586 ' HB ' ' HG3' ' A' ' 22' ' ' GLU . 1.5 m -47.87 -52.7 6.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.663 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.559 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 38.5 ptt180 -172.21 3.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.262 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.491 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 59.5 mtp180 -62.22 104.83 0.52 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.491 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 6.1 m-20 69.96 4.18 4.67 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.369 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.559 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 19.2 t -89.22 -68.3 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.259 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.8 m 63.53 160.81 0.1 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.092 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 81.9 p 47.39 34.28 3.21 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.007 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 19' ' ' MET . . . -82.58 -2.02 52.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.599 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.439 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.3 pt? -49.49 -18.82 0.46 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.55 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 38.4 t -68.01 -50.89 52.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.889 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -139.78 72.39 1.4 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.479 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.51 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -134.16 -43.78 0.79 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.931 0.396 . . . . 0.0 110.552 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.77 -77.15 1.65 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.27 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -68.5 -69.44 0.33 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -178.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.586 ' HG3' ' HB ' ' A' ' 8' ' ' VAL . 11.6 mm-40 -62.04 -6.49 2.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.899 0.38 . . . . 0.0 110.65 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.704 ' O ' HD23 ' A' ' 27' ' ' LEU . . . -97.95 -23.17 15.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.392 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.507 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 5.6 t80 -41.96 -55.91 2.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.42 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.41 -58.77 14.11 Favored Pre-proline 0 C--N 1.324 -0.507 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.485 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.553 ' HA ' ' HB2' ' A' ' 29' ' ' GLU . 66.9 Cg_exo -40.51 -36.5 1.78 Allowed 'Trans proline' 0 C--N 1.361 1.217 0 C-N-CA 122.622 2.214 . . . . 0.0 112.462 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.704 HD23 ' O ' ' A' ' 23' ' ' ALA . 3.8 mm? -53.03 -57.06 11.66 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.115 0.483 . . . . 0.0 110.282 178.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.497 HD12 HD12 ' A' ' 31' ' ' LEU . 1.1 tp -74.3 -31.51 62.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.693 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 26' ' ' PRO . 43.2 mt-10 -64.53 -29.77 70.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.584 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.0 t -66.38 -17.35 64.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.226 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.497 HD12 HD12 ' A' ' 28' ' ' LEU . 86.9 mt -67.53 -6.38 19.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 110.741 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.4 p -121.95 21.52 10.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -86.02 149.07 25.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.892 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.65 -31.75 73.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.368 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -82.54 163.3 21.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.734 0.302 . . . . 0.0 110.918 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -110.89 -41.75 4.17 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.476 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -58.9 -29.44 67.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.05 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.14 -42.86 27.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.718 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.465 ' HD2' HG21 ' A' ' 69' ' ' VAL . 33.7 ttm180 -61.99 -20.45 63.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.305 179.457 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.89 -66.26 2.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.282 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.69 -28.27 5.77 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.693 0.282 . . . . 0.0 111.216 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.515 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -62.57 -56.99 12.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.498 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.68 -31.54 72.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.785 179.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -70.87 -34.31 71.49 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.784 -178.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.4 mt -99.24 -21.22 5.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.851 0.358 . . . . 0.0 111.852 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.536 HD13 ' HG2' ' A' ' 57' ' ' PRO . 7.0 tt -61.06 -33.41 55.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -69.51 -22.46 76.53 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.663 -0.78 . . . . 0.0 113.152 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -70.81 -10.95 60.58 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -84.57 -34.82 23.13 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.696 ' HG3' HG12 ' A' ' 80' ' ' ILE . 14.5 mp0 59.74 47.09 10.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.977 0.418 . . . . 0.0 110.952 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.482 ' O ' HG23 ' A' ' 55' ' ' VAL . 10.8 t70 -127.5 178.84 5.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.19 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -60.81 -43.89 97.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.99 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.445 HH11 HD23 ' A' ' 28' ' ' LEU . 15.6 mmt180 -64.47 -10.81 27.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.724 0.297 . . . . 0.0 111.224 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.23 5.47 32.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.642 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 51' ' ' ASP . 94.6 t -90.7 -55.65 6.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.123 -179.132 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.469 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 31.9 tt0 -57.64 -48.87 96.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.177 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.536 ' HG2' HD13 ' A' ' 46' ' ' ILE . 80.2 Cg_exo -42.64 -53.3 3.91 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.379 2.053 . . . . 0.0 112.619 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.547 HD13 HD22 ' A' ' 77' ' ' LEU . 12.3 mt -54.27 -38.77 66.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.71 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 51.0 mm -60.71 -60.2 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -70.1 -7.78 44.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.89 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.764 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.0 OUTLIER -89.49 -42.85 11.23 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.507 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.602 HD13 HD22 ' A' ' 92' ' ' LEU . 8.1 mt -62.13 -9.36 7.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.257 0.551 . . . . 0.0 110.256 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -123.82 -4.79 8.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.635 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.53 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 25.5 t0 -61.06 -29.16 69.57 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.148 0.499 . . . . 0.0 111.107 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.679 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 12.3 t70 55.13 26.24 8.03 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.473 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.509 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 45.9 t -86.28 -3.38 58.97 Favored 'General case' 0 C--N 1.334 -0.104 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.127 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.12 -70.87 2.71 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.867 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.99 -54.53 14.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.216 0.532 . . . . 0.0 109.636 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.764 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.5 t -68.86 -30.31 46.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.272 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.679 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 41.7 ttt180 -71.45 -63.29 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.819 0.342 . . . . 0.0 111.079 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.5 m -61.81 -21.29 64.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.269 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -65.19 -22.17 68.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.341 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.427 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -88.46 -49.85 6.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -44.16 -32.63 1.28 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.727 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' A' ' 75' ' ' ARG . 6.2 ptp180 -79.75 -34.18 40.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 0.0 110.969 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.455 ' HB2' HD22 ' A' ' 58' ' ' LEU . 70.9 m -63.77 -35.99 82.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.453 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.547 HD22 HD13 ' A' ' 58' ' ' LEU . 3.9 mm? -55.46 -59.13 5.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.836 0.35 . . . . 0.0 110.318 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.464 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 34.3 tt0 -63.6 -26.37 68.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.948 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 76' ' ' SER . 21.4 mt-30 -62.32 -51.2 68.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.63 179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.696 HG12 ' HG3' ' A' ' 50' ' ' GLN . 69.0 mt -65.73 -55.59 18.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.681 179.576 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.78 116.67 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.716 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 149.5 177.34 23.5 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.431 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -63.11 -22.41 66.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.815 0.34 . . . . 0.0 110.976 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.534 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -63.09 -58.76 6.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.388 -179.811 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.471 ' H ' ' HG2' ' A' ' 84' ' ' ARG . 4.2 m -70.48 -22.93 24.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.927 0.394 . . . . 0.0 111.288 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -58.71 -35.16 72.21 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.944 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.71 -29.05 67.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.287 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.7 70.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.691 179.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.59 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 17.7 mmm -68.51 -51.72 39.98 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.38 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -54.95 -35.96 64.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.904 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.6 tmtm? -77.73 -25.91 49.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.491 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.602 HD22 HD13 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -86.59 -21.56 26.75 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.156 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.73 -21.13 59.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.725 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -80.35 -24.79 39.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.286 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 81.4 p -122.55 14.82 10.28 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.434 ' C ' ' HB2' ' A' ' 101' ' ' ARG . . . -61.24 128.27 43.88 Favored Glycine 0 N--CA 1.444 -0.782 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.989 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.491 HG23 HH22 ' A' ' 70' ' ' ARG . 4.3 t -139.82 130.16 25.38 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.916 0.389 . . . . 0.0 111.169 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.06 -108.84 2.44 Favored Glycine 0 CA--C 1.519 0.302 0 C-N-CA 121.113 -0.565 . . . . 0.0 113.282 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 103' ' ' VAL . 53.3 t80 -85.6 -40.35 16.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.655 0.264 . . . . 0.0 111.541 -179.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.454 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -48.43 -38.1 18.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 112.059 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.434 ' HB2' ' C ' ' A' ' 96' ' ' GLY . 42.5 ttt180 -73.82 -56.49 4.91 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -46.67 -21.71 0.22 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.179 0.514 . . . . 0.0 110.813 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 99' ' ' PHE . 37.5 t -74.49 -59.69 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.912 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.534 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.37 -44.48 84.44 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.406 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 51.7 t -63.9 -64.07 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -177.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -60.21 -37.57 80.7 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.59 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 24.8 t80 -60.74 -32.42 71.7 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 120.789 0.328 . . . . 0.0 111.074 -178.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 35.6 mt -54.19 -18.24 3.63 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.534 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -71.94 1.62 6.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.099 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 18.9 m -114.24 -80.09 0.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.187 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 61.0 m80 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.948 -179.966 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.3 tpt . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.846 0.355 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.85 -66.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.252 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -117.84 -83.1 0.64 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.117 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -159.03 47.99 0.32 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.925 0.393 . . . . 0.0 110.629 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.2 t30 60.55 10.26 2.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.923 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.505 ' HB2' ' NZ ' ' A' ' 6' ' ' LYS . 4.5 ttmp? -66.67 145.91 55.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.545 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.466 ' HB3' ' O ' ' A' ' 6' ' ' LYS . 0.3 OUTLIER 74.36 -37.45 0.36 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.566 0.541 . . . . 0.0 110.949 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.548 HG22 ' H ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER 50.23 175.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-O 121.591 0.71 . . . . 0.0 112.774 178.989 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.548 ' H ' HG22 ' A' ' 8' ' ' VAL . 14.7 mmm180 -91.29 44.65 1.2 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.794 -179.256 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.621 ' HA ' ' HG2' ' A' ' 22' ' ' GLU . 42.7 ttt180 -61.89 104.51 0.46 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 67.93 14.71 9.44 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.103 0.477 . . . . 0.0 109.971 -178.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 28.6 t -96.75 77.82 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.501 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.7 t 64.24 120.32 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.471 179.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.415 ' HB ' ' HB2' ' A' ' 17' ' ' SER . 29.5 p 57.84 139.06 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.825 178.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.26 -66.67 0.89 Allowed 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.558 HD12 ' H ' ' A' ' 16' ' ' LEU . 1.7 mp -86.16 -11.77 51.66 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.047 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.415 ' HB2' ' HB ' ' A' ' 14' ' ' THR . 48.0 t -44.8 -52.73 8.18 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 174.54 40.64 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.52 ' HB3' ' HB3' ' A' ' 22' ' ' GLU . 23.0 mmt -74.57 -6.71 50.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.782 0.325 . . . . 0.0 110.908 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.57 -105.49 1.08 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.911 -0.661 . . . . 0.0 113.115 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.12 -38.45 73.47 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.695 0.283 . . . . 0.0 111.368 -179.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.621 ' HG2' ' HA ' ' A' ' 10' ' ' ARG . 21.3 tp10 -80.65 -18.22 48.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.079 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.512 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -96.94 -2.95 42.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.702 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.478 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 11.7 t80 -54.71 -59.98 3.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.342 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.41 -55.56 34.38 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.106 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.512 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 98.5 Cg_exo -42.43 -31.66 1.93 Allowed 'Trans proline' 0 C--N 1.36 1.174 0 C-N-CA 122.298 1.998 . . . . 0.0 111.74 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.481 ' HB2' HH12 ' A' ' 53' ' ' ARG . 33.5 mt -67.91 -58.62 4.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.305 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.595 HD12 HD12 ' A' ' 31' ' ' LEU . 13.7 tp -62.06 -21.92 65.33 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.376 179.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -77.2 -27.47 53.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.634 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.468 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 74.1 m -64.43 -25.81 68.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.977 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.672 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 87.9 mt -65.27 -17.05 64.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.806 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.0 m -102.4 16.37 26.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.107 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.468 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 92.4 m-20 -95.29 143.88 26.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.995 0.426 . . . . 0.0 111.26 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -67.78 -16.51 64.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.903 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -85.33 160.7 19.75 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.66 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 7.3 p90 -109.17 -35.96 6.17 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.455 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.434 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 71.3 ttt180 -60.26 -32.07 70.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.824 0.345 . . . . 0.0 111.224 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 59.3 mt -82.43 -38.39 15.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.501 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.672 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 43.1 ttm180 -64.58 -46.79 81.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.423 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -59.49 -47.89 88.65 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.67 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.93 -27.96 54.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.716 0.293 . . . . 0.0 111.253 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.463 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.33 -56.42 22.36 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.038 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.402 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -65.54 -28.54 69.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.948 0.404 . . . . 0.0 110.801 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.3 m95 -55.4 -42.87 74.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.228 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.8 mt -99.08 -20.37 5.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.545 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.508 HD11 ' NH1' ' A' ' 53' ' ' ARG . 0.2 OUTLIER -56.81 -37.33 53.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.58 -179.264 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.01 -20.5 60.26 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.93 -0.653 . . . . 0.0 113.399 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -69.83 -21.12 63.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -82.61 -27.74 31.27 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.626 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.9 OUTLIER 57.66 27.25 13.99 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.94 0.4 . . . . 0.0 111.38 179.828 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -100.96 158.38 16.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.162 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -56.77 -36.75 70.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.477 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.523 ' O ' ' HD2' ' A' ' 53' ' ' ARG . 0.8 OUTLIER -63.73 -27.55 69.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.891 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.498 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -96.11 0.14 50.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.228 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.6 t -90.83 -41.05 13.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.392 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.555 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 19.1 tt0 -60.61 -49.18 91.02 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 50.5 Cg_exo -54.03 -17.35 10.93 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.647 2.231 . . . . 0.0 113.222 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.54 HD22 ' OG ' ' A' ' 76' ' ' SER . 12.9 mt -86.54 -31.79 21.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.844 0.354 . . . . 0.0 110.93 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.6 mm -63.33 -52.62 56.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.984 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -70.17 -44.55 68.54 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' ' 69' ' ' VAL . 2.0 tp -57.66 -35.74 70.96 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -177.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.709 HD13 HD22 ' A' ' 92' ' ' LEU . 35.2 mt -59.01 -12.08 4.22 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -113.08 -3.6 13.96 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.42 ' OD1' ' HA ' ' A' ' 61' ' ' LEU . 0.9 OUTLIER -60.98 -33.62 73.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.153 0.501 . . . . 0.0 111.117 179.945 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.532 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 17.9 t70 50.34 26.77 2.4 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.373 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.477 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.6 t -82.37 -17.34 45.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.943 0.401 . . . . 0.0 110.372 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 122.2 -114.45 2.5 Favored Glycine 0 N--CA 1.452 -0.254 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.444 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.434 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -55.06 -27.94 48.53 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.376 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.642 HG12 ' HG ' ' A' ' 61' ' ' LEU . 39.5 t -64.92 -38.94 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.621 178.643 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.532 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 44.1 ttp180 -74.69 -40.15 61.55 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.595 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 55.0 m -64.85 -33.74 76.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.09 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.35 -60.35 8.67 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.444 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.538 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . . . -57.12 -31.53 65.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.872 0.368 . . . . 0.0 111.048 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.97 -59.05 5.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.737 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -67.11 -37.51 84.0 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.098 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.54 ' OG ' HD22 ' A' ' 58' ' ' LEU . 60.7 p -53.29 -40.22 64.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.752 0.31 . . . . 0.0 111.237 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.421 ' HB3' HG13 ' A' ' 85' ' ' VAL . 35.2 mt -67.7 -60.17 2.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.828 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -53.18 -25.8 15.0 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.111 0.481 . . . . 0.0 110.219 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.462 HE21 ' HA ' ' A' ' 76' ' ' SER . 4.7 tt0 -68.23 -41.55 81.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.066 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.626 HG12 ' HG3' ' A' ' 50' ' ' GLN . 89.3 mt -63.13 -55.4 23.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.727 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.42 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 66.24 119.34 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.57 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.77 -179.97 27.92 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.278 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -66.38 -33.96 76.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.72 0.295 . . . . 0.0 110.922 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.512 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -62.97 -38.31 90.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.11 -179.78 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.431 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 19.8 t -64.8 -37.16 79.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.819 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 39.4 ttp180 -59.19 -27.36 65.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.513 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.29 76.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.025 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.65 88.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.929 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.54 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 14.4 mmt -66.77 -49.41 65.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.691 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -56.42 -34.98 67.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.82 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.14 -27.59 48.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.985 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.709 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -86.17 -19.79 29.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.16 0.505 . . . . 0.0 109.745 179.663 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.69 -19.95 60.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.692 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.51 -27.6 37.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.332 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 15.6 p -120.18 18.3 12.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.333 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -53.48 125.92 33.12 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.968 -1.015 . . . . 0.0 113.268 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.4 t -139.79 130.32 25.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.035 0.445 . . . . 0.0 110.845 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.23 -121.29 26.17 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.005 -0.617 . . . . 0.0 113.132 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -75.87 -36.53 59.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.66 0.267 . . . . 0.0 111.685 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.495 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.84 -39.72 59.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.871 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -66.33 -59.98 3.2 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.485 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -45.7 -32.85 2.64 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.869 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.442 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 19.9 t -58.98 -59.92 3.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.656 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.516 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.33 -56.4 22.56 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 88.6 t -59.46 -60.68 2.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -178.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -55.4 -37.42 67.58 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.54 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 43.5 t80 -62.84 -22.77 66.9 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 120.907 0.384 . . . . 0.0 110.958 -178.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.4 mt -58.39 -17.21 18.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.166 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -64.79 -24.08 67.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.662 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.1 p -102.39 -58.01 1.95 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.818 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 44.1 m80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.295 -0.86 . . . . 0.0 110.835 179.891 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.7 mmm . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.821 0.344 . . . . 0.0 110.948 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.18 6.45 1.53 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.096 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 60.25 11.89 3.06 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.255 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -145.49 -46.82 0.22 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.138 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -76.94 79.3 3.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.054 0.454 . . . . 0.0 111.555 -179.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -115.49 56.51 0.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.019 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 15.0 m95 63.33 15.99 9.13 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.115 -179.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.2 t -80.56 -51.09 16.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.861 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.526 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 99.1 mtt180 -137.26 -12.14 1.63 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.871 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 0.6 OUTLIER -61.48 104.29 0.4 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.262 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.462 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 27.1 t70 74.81 -19.34 0.39 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.283 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.526 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 60.4 t -56.25 -65.9 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.614 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.9 t 68.04 -81.07 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.382 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 46.7 p -112.08 95.05 5.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.883 0.373 . . . . 0.0 111.515 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.651 ' HB1' ' HB2' ' A' ' 19' ' ' MET . . . -95.74 -2.54 47.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.371 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.653 HD12 ' H ' ' A' ' 16' ' ' LEU . 4.7 mp -56.92 -18.64 14.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.93 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 52.3 m -47.67 -52.1 19.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.484 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 174.49 7.43 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.745 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.651 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 11.3 mtp -61.65 -41.64 97.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.126 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.3 170.92 16.18 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.73 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.3 t70 62.37 -80.11 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.9 0.381 . . . . 0.0 110.843 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.82 -13.65 59.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.393 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.452 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -100.2 -0.18 39.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.395 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.499 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 1.5 t80 -63.34 -48.64 77.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.108 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.444 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 8.6 mt-10 -62.58 -58.1 18.76 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.949 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 11.8 Cg_endo -56.01 -15.54 14.01 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 121.859 1.706 . . . . 0.0 110.955 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.828 HD21 HG13 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -79.12 -38.81 35.24 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.593 179.293 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.502 HD11 ' HG2' ' A' ' 53' ' ' ARG . 7.4 mt -82.18 -22.17 36.14 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.383 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.13 -31.96 69.41 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.512 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.49 ' OG ' HG22 ' A' ' 38' ' ' ILE . 1.5 t -66.18 -26.52 67.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.638 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.589 ' HA ' ' HD2' ' A' ' 39' ' ' ARG . 76.4 mt -56.35 -17.74 8.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.864 -179.424 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.2 m -90.7 21.73 3.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.612 0.244 . . . . 0.0 111.491 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -114.27 123.37 49.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.988 0.423 . . . . 0.0 111.313 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -67.88 -5.6 17.55 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.375 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -75.89 155.85 34.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 0.0 110.947 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.3 p-90 -89.79 -35.0 15.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.068 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -69.35 -33.24 72.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.901 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.49 HG22 ' OG ' ' A' ' 30' ' ' SER . 40.5 mm -82.11 -55.01 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.876 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.589 ' HD2' ' HA ' ' A' ' 31' ' ' LEU . 8.2 tpt180 -57.25 -40.37 77.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.053 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.27 -58.62 10.04 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.931 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.97 -27.31 0.88 Allowed 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.05 -56.78 9.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.843 0.354 . . . . 0.0 111.196 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.578 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -66.41 -37.22 84.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.953 0.406 . . . . 0.0 111.008 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -55.77 -33.4 64.31 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.723 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.3 mm -98.75 -20.45 5.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.187 0.518 . . . . 0.0 110.849 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.828 HG13 HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -60.74 -41.38 88.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.754 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.75 -16.08 36.75 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.716 -179.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -70.73 -43.34 69.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.474 0.178 . . . . 0.0 111.227 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -92.82 105.7 17.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.78 0.324 . . . . 0.0 110.631 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' ' 80' ' ' ILE . 23.7 mp0 -71.82 74.37 0.86 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.524 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -127.82 155.49 44.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.161 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.409 ' HA ' HG23 ' A' ' 55' ' ' VAL . 9.4 pt-20 -64.92 -29.13 70.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.424 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.502 ' HG2' HD11 ' A' ' 28' ' ' LEU . 33.4 ttm180 -69.26 -10.43 57.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.337 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.611 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -105.97 12.97 29.94 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.882 0.372 . . . . 0.0 111.009 -179.473 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.409 HG23 ' HA ' ' A' ' 52' ' ' GLU . 53.2 t -86.63 -50.11 14.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.009 -0.542 . . . . 0.0 112.182 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 42.1 tt0 -55.08 -48.43 96.11 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 94.5 Cg_exo -45.47 -33.77 9.8 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.426 2.084 . . . . 0.0 112.987 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.428 HD22 ' HB2' ' A' ' 76' ' ' SER . 8.7 mt -75.17 -40.77 59.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.829 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.487 HD11 ' HA ' ' A' ' 88' ' ' ALA . 41.0 mm -54.78 -52.96 37.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.16 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -70.09 -22.33 63.05 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.602 ' HG ' HG12 ' A' ' 69' ' ' VAL . 3.0 mp -89.42 -40.13 12.93 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.526 HD11 HD11 ' A' ' 77' ' ' LEU . 13.3 mt -62.2 -10.88 11.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.349 0.595 . . . . 0.0 110.346 -179.238 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -90.67 -39.86 12.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.98 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.485 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 34.5 m-20 -56.52 -179.8 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.76 -178.181 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -153.33 29.7 0.49 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.762 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.424 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 53.3 m -83.66 -3.41 57.72 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.285 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.49 -98.75 2.41 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.392 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -48.69 -32.72 8.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.235 0.54 . . . . 0.0 110.012 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.602 HG12 ' HG ' ' A' ' 61' ' ' LEU . 60.1 t -72.8 -56.78 8.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.104 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 7.3 tmm_? -65.2 -63.66 1.05 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.339 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 97.3 p -52.05 -22.84 4.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.293 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.16 -43.65 98.33 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.594 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.51 ' O ' HD12 ' A' ' 77' ' ' LEU . . . -75.32 -36.84 61.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.573 0.225 . . . . 0.0 111.377 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.22 -40.47 64.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.526 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.3 ptp180 -84.45 -16.58 42.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.489 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.428 ' HB2' HD22 ' A' ' 58' ' ' LEU . 54.9 m -65.91 -45.05 83.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.792 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.54 ' HA ' HG21 ' A' ' 85' ' ' VAL . 5.0 mp -55.8 -59.4 4.93 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.454 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -53.74 -29.46 39.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.804 -0.18 . . . . 0.0 111.099 179.716 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 67.4 mt-30 -70.6 -31.99 69.18 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 121.018 0.437 . . . . 0.0 110.346 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.529 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 95.2 mt -80.43 -60.71 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.173 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.76 113.38 0.01 OUTLIER Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.978 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.91 164.1 12.0 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.633 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -64.03 -26.37 68.53 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.805 0.336 . . . . 0.0 110.837 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.556 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -65.95 -53.49 38.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.764 179.894 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.556 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 12.3 p -70.8 -24.77 25.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.389 0.614 . . . . 0.0 110.263 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.439 ' O ' ' HG3' ' A' ' 89' ' ' MET . 17.0 ttp180 -55.88 -20.87 17.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.72 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.02 -34.07 64.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.364 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.487 ' HA ' HD11 ' A' ' 59' ' ' ILE . . . -60.0 -48.58 81.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.851 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.542 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.23 -31.75 69.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.375 179.739 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.35 -36.51 83.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.164 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 42.7 mmtm -79.94 -28.11 39.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.121 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.491 HD22 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -82.48 -24.03 34.42 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.78 -12.49 61.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.738 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -95.86 -14.87 22.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.914 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.0 p -135.12 16.99 3.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.598 0.713 . . . . 0.0 109.199 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -61.5 148.19 47.22 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 114.734 -1.121 . . . . 0.0 113.226 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.426 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 4.3 t -151.25 130.35 12.65 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.79 -0.705 . . . . 0.0 111.001 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.03 -130.11 50.53 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.976 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.449 ' O ' HG23 ' A' ' 103' ' ' VAL . 78.0 t80 -60.42 -47.54 85.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.635 0.255 . . . . 0.0 111.389 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.435 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.17 -41.5 49.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.51 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.426 ' HB2' ' N ' ' A' ' 97' ' ' THR . 9.3 tpt180 -61.52 -61.68 2.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.384 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -53.3 -27.69 24.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.119 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 99' ' ' PHE . 13.5 t -63.97 -45.79 95.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.954 -179.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -62.56 -58.95 5.74 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 106' ' ' ASN . 7.3 p -64.43 -52.84 50.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.515 ' N ' HG13 ' A' ' 105' ' ' VAL . 27.1 t-20 -55.78 -32.49 63.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.646 0.26 . . . . 0.0 111.616 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -60.32 -29.24 68.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.058 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 14.1 mt -51.44 -22.36 2.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.65 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.74 3.69 3.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.268 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 53.7 m -105.37 -60.36 1.63 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.788 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.418 ' HD2' ' HD3' ' A' ' 86' ' ' ARG . 82.9 t60 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.638 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ttt . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.808 0.337 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.25 -16.27 38.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.157 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -86.13 -32.26 21.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.142 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -82.99 -10.28 58.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.949 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -158.38 127.68 5.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.883 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -127.33 -27.61 2.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.698 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 3.3 p-90 -152.02 122.23 7.2 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.874 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.631 HG23 ' HA ' ' A' ' 22' ' ' GLU . 2.4 p -128.62 -44.24 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.366 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 -109.25 -16.88 13.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.093 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.437 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 33.6 ttp180 -53.51 113.39 1.15 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.437 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 28.7 t70 75.01 -18.46 0.44 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.264 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.419 ' H ' ' C ' ' A' ' 10' ' ' ARG . 54.4 t -85.56 125.41 40.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.019 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 41.4 t -162.25 -21.48 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.544 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.5 m -144.57 8.78 1.35 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.233 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.0 -1.94 58.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.516 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.623 ' HA ' ' HB1' ' A' ' 23' ' ' ALA . 1.4 pt? -53.01 -13.84 0.51 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.476 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.5 t -54.68 -36.61 64.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.208 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -171.87 80.79 0.06 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.883 0.373 . . . . 0.0 111.747 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.616 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 20.7 mmt -133.94 -43.6 0.8 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.777 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.45 ' HA2' ' HZ ' ' A' ' 49' ' ' PHE . . . 76.35 144.89 1.62 Allowed Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.905 -0.665 . . . . 0.0 113.277 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 16.8 t70 62.38 -79.92 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 122.619 0.368 . . . . 0.0 111.763 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.631 ' HA ' HG23 ' A' ' 8' ' ' VAL . 12.8 pt-20 -62.72 -11.82 19.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.068 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.623 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -100.94 -6.22 24.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.666 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.424 ' HA ' HD23 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -59.47 -49.42 77.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.999 0.428 . . . . 0.0 110.805 -179.81 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.418 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 10.8 mt-10 -63.42 -58.92 13.43 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.438 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.463 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 15.0 Cg_endo -56.46 -14.38 12.6 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 121.87 1.714 . . . . 0.0 111.062 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.546 HD11 HG12 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -82.9 -39.0 22.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.535 178.954 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.429 HD12 HD12 ' A' ' 31' ' ' LEU . 8.7 tp -85.86 -21.38 28.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.325 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -75.81 -37.56 58.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.708 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 60.9 p -65.3 -23.99 67.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.27 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.429 HD12 HD12 ' A' ' 28' ' ' LEU . 86.2 mt -59.2 -7.26 1.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.673 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.5 p -89.92 19.62 4.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.21 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.543 ' ND2' ' HB ' ' A' ' 38' ' ' ILE . 5.9 p30 -88.19 147.76 24.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.138 0.494 . . . . 0.0 111.432 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.84 -25.74 65.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.622 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.1 162.32 28.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.968 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -110.12 -26.05 9.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.95 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 37' ' ' ARG . 23.4 ttt180 -58.9 -48.16 82.42 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.742 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.543 ' HB ' ' ND2' ' A' ' 33' ' ' ASN . 29.4 mm -56.44 -49.85 75.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.339 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 77.8 mtt180 -52.81 -23.84 7.73 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.598 178.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -60.78 -66.59 2.6 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.484 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.3 -42.33 69.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.778 0.323 . . . . 0.0 111.224 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.447 ' HB1' HD12 ' A' ' 27' ' ' LEU . . . -58.02 -54.9 41.73 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.676 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.82 -34.72 74.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.6 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -68.7 -28.07 66.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.773 -179.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.2 mm -91.41 -21.6 6.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.927 0.394 . . . . 0.0 110.54 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.648 HG23 ' HB1' ' A' ' 54' ' ' ALA . 2.4 mm -55.78 -35.16 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.251 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.91 -28.26 63.19 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.869 -0.681 . . . . 0.0 113.022 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -55.4 -51.44 66.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.9 0.381 . . . . 0.0 110.255 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.45 ' HZ ' ' HA2' ' A' ' 20' ' ' GLY . 37.2 m-85 -83.98 115.58 22.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.741 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.68 25.4 0.78 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.132 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.506 ' O ' HG23 ' A' ' 55' ' ' VAL . 6.2 m-20 -84.0 162.45 20.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.376 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.441 ' CD ' ' H ' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -61.58 -37.06 82.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.589 -179.551 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.6 ttp180 -64.45 -11.32 32.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.986 0.422 . . . . 0.0 110.367 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.648 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -106.02 -10.99 16.3 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.709 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 51' ' ' ASP . 93.6 t -79.05 -44.51 24.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.654 -179.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.563 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -57.69 -51.06 84.51 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.496 -179.564 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.563 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.0 Cg_exo -45.29 -51.67 7.52 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.296 1.997 . . . . 0.0 112.252 179.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.522 HD22 ' HA ' ' A' ' 73' ' ' ALA . 16.7 mt -60.63 -35.57 76.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.484 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 55' ' ' VAL . 42.6 mm -62.78 -59.75 3.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.703 0.287 . . . . 0.0 111.585 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.457 ' H ' ' HG3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -70.07 -4.97 23.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.693 -179.341 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.726 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -89.59 -44.44 10.08 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -179.353 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.689 HD13 HD22 ' A' ' 92' ' ' LEU . 5.1 mt -56.74 -15.81 5.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.887 0.375 . . . . 0.0 111.4 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -110.85 -9.33 14.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.501 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.402 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.7 t70 -61.06 -33.43 73.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.108 0.48 . . . . 0.0 111.212 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.583 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 16.5 t70 54.84 28.98 11.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.688 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.497 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 37.8 t -85.33 -10.94 55.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.636 0.255 . . . . 0.0 111.404 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 96.09 -84.33 0.85 Allowed Glycine 0 C--O 1.228 -0.26 0 C-N-CA 120.712 -0.756 . . . . 0.0 111.97 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.66 -41.52 98.2 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.726 HG12 ' HG ' ' A' ' 61' ' ' LEU . 5.2 t -71.97 -43.46 67.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.133 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.583 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 8.3 ttt180 -69.52 -63.36 1.09 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.703 0.287 . . . . 0.0 111.027 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.9 m -52.49 -23.06 5.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.821 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -66.9 -37.43 92.19 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.147 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.522 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -69.72 -47.47 62.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.649 0.261 . . . . 0.0 111.003 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.23 -26.2 62.58 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.214 0.531 . . . . 0.0 110.002 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.9 ttt180 -82.93 -40.45 20.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.449 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.476 ' HB2' HD22 ' A' ' 58' ' ' LEU . 69.8 m -66.94 -33.24 75.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.676 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.553 HD11 HD11 ' A' ' 62' ' ' LEU . 96.8 mt -65.36 -59.72 3.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.675 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.426 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 36.8 tt0 -51.57 -23.09 3.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.161 0.505 . . . . 0.0 110.032 178.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -68.02 -48.14 66.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.985 179.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 82.2 mt -58.21 -60.22 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.713 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 61.13 107.16 0.01 OUTLIER Glycine 0 C--N 1.332 0.356 0 C-N-CA 121.092 -0.575 . . . . 0.0 113.07 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 155.33 -175.47 33.26 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.621 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -71.34 -26.81 62.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.842 0.353 . . . . 0.0 110.737 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.598 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -68.68 -49.71 56.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 -179.746 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.598 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 11.4 p -70.83 -26.93 28.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.276 0.56 . . . . 0.0 110.798 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.431 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 54.7 ttt180 -58.78 -24.59 62.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.532 -179.157 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.94 -29.0 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.93 0.395 . . . . 0.0 110.701 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.73 -37.68 88.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.71 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.537 ' SD ' HD13 ' A' ' 77' ' ' LEU . 6.7 mmm -66.76 -44.38 81.55 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 12.3 mm-40 -57.42 -38.63 74.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.146 178.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -74.49 -29.49 61.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.547 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.689 HD22 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -87.25 -23.48 24.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.005 0.431 . . . . 0.0 110.296 179.48 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.84 -29.16 69.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.422 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.539 ' HG3' HG23 ' A' ' 95' ' ' THR . 11.2 pt-20 -80.17 -18.13 50.53 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.245 0.545 . . . . 0.0 109.779 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.539 HG23 ' HG3' ' A' ' 94' ' ' GLU . 72.0 p -121.93 21.91 10.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.935 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.432 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -60.64 123.12 31.9 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 114.843 -1.071 . . . . 0.0 113.687 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.3 t -147.76 130.06 15.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.809 0.337 . . . . 0.0 110.786 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.7 -132.77 20.42 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.158 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -77.86 -30.89 51.13 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.658 0.266 . . . . 0.0 111.321 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.539 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -55.27 -37.92 67.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.468 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.432 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 44.5 ttt180 -67.41 -59.02 3.73 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.667 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.2 tppt? -47.33 -21.69 0.33 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.961 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.457 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 18.7 t -75.4 -56.98 7.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.92 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.514 ' O ' ' HG ' ' A' ' 108' ' ' LEU . . . -51.31 -57.6 8.44 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 113.502 0.926 . . . . 0.0 113.502 -178.653 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.8 t -58.35 -63.6 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -176.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -59.03 -35.2 72.91 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.532 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 42.9 t80 -63.29 -25.76 68.46 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-O 120.829 0.347 . . . . 0.0 111.116 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 96.8 mt -56.59 -20.79 22.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.882 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -62.65 -12.35 22.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.977 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.4 p -132.05 20.01 4.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.315 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 65.6 m80 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.065 179.59 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.6 ptm . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.846 0.355 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -167.33 103.28 0.52 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.174 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 61.11 10.33 2.86 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.43 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -89.08 -55.43 3.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.835 0.35 . . . . 0.0 110.816 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -100.77 93.61 5.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -67.61 -70.07 0.28 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.838 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 40.8 m95 -72.28 87.45 1.13 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.485 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.418 HG13 ' HG2' ' A' ' 9' ' ' ARG . 12.6 p -123.69 -27.0 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.284 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.418 ' HG2' HG13 ' A' ' 8' ' ' VAL . 8.4 ptp180 -145.54 -27.52 0.45 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.191 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.657 ' HA ' ' HE ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -58.87 137.61 57.71 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.967 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.468 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 9.3 m-20 68.38 2.9 3.5 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 123.341 0.4 . . . . 0.0 111.428 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 46.5 t -112.29 129.32 68.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.006 0.431 . . . . 0.0 111.54 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 41.1 t -161.65 -66.14 0.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.406 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 39.0 p -101.39 11.95 38.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.701 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.07 -1.76 57.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.15 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.432 ' N ' HD23 ' A' ' 16' ' ' LEU . 2.6 pt? -51.15 -16.56 0.5 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.678 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.6 t -50.57 -40.38 52.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.031 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -175.47 94.87 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.346 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 12.8 mmt -133.66 -43.19 0.83 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.091 179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 121.73 -102.23 0.8 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.622 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.446 ' HA ' ' HB2' ' A' ' 24' ' ' PHE . 3.1 p-10 -102.93 -26.98 12.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.877 0.37 . . . . 0.0 111.256 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -62.23 -32.15 72.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.46 -179.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.469 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.17 0.68 27.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.611 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.548 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 2.7 t80 -63.47 -48.84 76.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.819 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.523 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.3 -50.39 74.82 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -179.207 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.523 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 87.6 Cg_exo -41.93 -24.46 0.3 Allowed 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 122.204 1.936 . . . . 0.0 111.719 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 47.1 mt -76.06 -53.02 8.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.133 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 31' ' ' LEU . 24.6 tp -66.98 -24.16 66.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.889 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -76.27 -42.71 44.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.558 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 52.3 m -66.43 -11.18 50.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.981 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 28' ' ' LEU . 38.7 mt -67.17 -10.11 46.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.102 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.7 t -100.21 14.36 31.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.511 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -68.91 150.08 48.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.83 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -63.09 -39.4 94.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.038 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -76.12 156.75 33.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.797 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 7.5 m0 -99.93 -33.03 10.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.644 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -64.94 -46.72 80.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.864 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.3 mt -60.4 -39.27 80.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.603 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.611 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 39.0 ttm180 -63.78 -20.75 66.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.335 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.08 -57.56 11.61 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.778 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.66 -36.44 4.87 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.456 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -67.21 -50.86 59.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.91 0.386 . . . . 0.0 110.69 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.406 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -64.05 -32.77 74.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.989 179.454 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -70.8 -33.92 71.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.49 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.0 mt -99.21 -19.36 5.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.461 HD13 ' HG2' ' A' ' 57' ' ' PRO . 5.6 tt -59.31 -38.03 72.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -178.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.438 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -76.14 -14.01 82.69 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.512 -0.851 . . . . 0.0 112.505 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -70.69 -15.46 62.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.558 0.218 . . . . 0.0 111.148 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -83.02 -22.77 33.5 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.322 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 59.94 24.97 14.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.216 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -93.45 163.36 13.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.152 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.493 ' O ' HG22 ' A' ' 55' ' ' VAL . 13.4 tp10 -66.08 -35.37 80.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.98 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.8 ttm180 -64.3 -10.03 21.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.317 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.548 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -101.96 18.63 20.18 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.493 HG22 ' O ' ' A' ' 52' ' ' GLU . 20.4 m -91.8 -46.35 14.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.478 ' N ' HG23 ' A' ' 55' ' ' VAL . 4.6 tp10 -59.8 -49.45 91.56 Favored Pre-proline 0 CA--C 1.531 0.216 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.0 Cg_exo -45.16 -53.08 5.7 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.993 1.795 . . . . 0.0 111.895 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.479 HD22 ' HB2' ' A' ' 76' ' ' SER . 7.8 mt -57.61 -36.81 72.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.13 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 74.9 mt -63.47 -59.53 4.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.416 ' HG3' HD13 ' A' ' 61' ' ' LEU . 13.6 pttm -66.28 -37.64 85.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.795 0.331 . . . . 0.0 111.631 -178.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.748 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -54.48 -51.82 63.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.923 -179.456 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.486 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 75.1 mt -58.35 -15.85 12.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.876 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.04 -22.94 15.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.586 179.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -61.34 -36.17 79.44 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.089 0.471 . . . . 0.0 111.302 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.539 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 20.3 t70 57.44 28.06 14.87 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.019 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.51 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 8.0 t -73.35 -11.86 60.63 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.747 0.308 . . . . 0.0 111.116 -179.766 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.34 -79.01 0.51 Allowed Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.08 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.96 -39.27 69.47 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.748 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.5 t -71.79 -41.49 70.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.84 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.539 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 6.2 tmm_? -67.73 -58.54 4.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.179 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.0 m -57.75 -35.13 70.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.7 -179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -55.75 -30.29 56.23 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.72 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.28 -52.02 15.47 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -45.98 -47.41 16.66 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -70.13 -30.13 67.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.604 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.479 ' HB2' HD22 ' A' ' 58' ' ' LEU . 50.3 m -65.22 -38.64 91.04 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.429 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.435 ' HG ' HG11 ' A' ' 85' ' ' VAL . 8.2 mp -55.56 -59.36 4.94 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.775 0.321 . . . . 0.0 111.026 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 41.7 mt-10 -55.46 -35.96 66.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.974 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' A' ' 76' ' ' SER . 95.2 mt-30 -61.99 -23.63 66.54 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.234 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.509 HG22 ' HD2' ' A' ' 84' ' ' ARG . 39.8 mt -90.22 -61.72 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.444 ' N ' ' NH1' ' A' ' 84' ' ' ARG . . . 64.33 125.62 0.01 OUTLIER Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.962 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.458 ' O ' ' NH2' ' A' ' 84' ' ' ARG . . . 141.97 -169.95 25.1 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.611 -0.804 . . . . 0.0 113.149 179.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' A' ' 86' ' ' ARG . 34.8 tt0 -72.91 -22.51 60.73 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.77 ' NE ' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.27 -65.38 0.68 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.187 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.77 ' H ' ' NE ' ' A' ' 84' ' ' ARG . 47.8 t -70.8 -20.52 22.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.08 0.467 . . . . 0.0 109.822 178.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.591 ' HA ' ' HE2' ' A' ' 89' ' ' MET . 2.2 tmm_? -46.25 -36.25 5.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.207 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -86.22 -27.86 24.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.705 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.441 ' HB3' HG13 ' A' ' 85' ' ' VAL . . . -65.19 -49.57 69.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.902 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.591 ' HE2' ' HA ' ' A' ' 86' ' ' ARG . 9.3 ptt? -58.73 -41.56 86.72 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.84 0.352 . . . . 0.0 110.294 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -63.2 -29.97 71.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.026 0.441 . . . . 0.0 109.855 178.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.451 ' O ' ' HD3' ' A' ' 91' ' ' LYS . 10.8 tmtt? -71.06 -42.17 69.77 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.562 179.082 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.625 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -74.8 -24.47 58.65 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.543 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.16 -27.68 64.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.46 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -81.57 -26.58 34.85 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.619 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 74.1 p -109.67 20.91 17.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.352 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -55.41 115.59 5.96 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.027 -0.988 . . . . 0.0 113.441 -178.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.6 m -140.0 129.91 24.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.719 0.295 . . . . 0.0 110.697 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.18 -141.92 46.97 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.812 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -63.83 -25.28 68.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 111.202 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.563 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -55.63 -44.07 76.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.815 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.459 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 34.3 ttp180 -64.07 -53.77 44.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.704 0.288 . . . . 0.0 111.412 -179.69 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.6 tptp -50.28 -22.04 1.62 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.887 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.563 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 4.8 t -73.16 -57.58 6.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.901 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.625 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.32 -52.66 64.44 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 51.1 t -60.7 -45.87 96.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.264 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.52 HD22 ' N ' ' A' ' 106' ' ' ASN . 0.9 OUTLIER -70.75 -39.03 73.53 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.166 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.515 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 41.2 t80 -63.51 -23.92 67.59 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.163 0.506 . . . . 0.0 111.024 -178.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.493 ' HG ' ' HE3' ' A' ' 89' ' ' MET . 0.5 OUTLIER -49.98 -30.87 11.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.88 179.516 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.579 ' HG3' HG23 ' A' ' 110' ' ' THR . 12.1 pt-20 -65.12 -8.89 18.79 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.579 HG23 ' HG3' ' A' ' 109' ' ' GLU . 62.9 p -130.44 19.12 5.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.618 0.247 . . . . 0.0 111.42 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.2 m80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.994 179.866 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.8 mmm . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.835 0.35 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.43 -52.48 4.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.143 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -143.47 105.98 4.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.056 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -154.98 -60.67 0.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.649 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -71.1 106.15 3.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.568 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -168.79 -0.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.992 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -131.72 10.16 4.68 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.325 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.5 HG21 ' HB2' ' A' ' 21' ' ' ASP . 31.5 m -90.44 44.27 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.218 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.469 ' HD3' ' HA2' ' A' ' 20' ' ' GLY . 33.2 ptt180 -159.5 -9.94 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.505 -179.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -53.94 105.26 0.13 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.356 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.4 t70 71.6 43.37 0.59 Allowed 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.291 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.474 ' O ' ' HB2' ' A' ' 17' ' ' SER . 38.3 t -141.01 109.87 2.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.333 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.535 ' HB3' HG21 ' A' ' 45' ' ' ILE . 9.7 p 64.55 -173.67 0.17 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.96 179.47 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.7 p -119.59 -76.17 0.58 Allowed 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.277 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.76 77.49 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.185 0.517 . . . . 0.0 110.555 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.726 HD13 ' HB2' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -79.28 -13.53 59.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.381 -179.559 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.474 ' HB2' ' O ' ' A' ' 12' ' ' VAL . 10.8 t -86.93 -5.56 59.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.186 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 18' ' ' ARG . 29.8 ttp180 -102.43 3.59 37.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.525 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.776 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 14.7 mmt -125.81 -41.38 1.98 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.763 0.315 . . . . 0.0 110.924 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.469 ' HA2' ' HD3' ' A' ' 9' ' ' ARG . . . 110.49 -144.82 17.18 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.754 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.5 ' HB2' HG21 ' A' ' 8' ' ' VAL . 23.4 t70 -63.54 -26.88 68.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.744 0.306 . . . . 0.0 110.605 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.63 -18.19 65.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.222 0.534 . . . . 0.0 110.148 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.776 ' HB2' ' HB2' ' A' ' 19' ' ' MET . . . -83.9 -12.49 55.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.132 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.494 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -59.38 -50.62 73.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.652 -179.604 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.437 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -57.56 -57.36 25.83 Favored Pre-proline 0 C--N 1.325 -0.5 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.185 -179.935 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.527 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 1.1 Cg_endo -49.95 -26.39 14.12 Favored 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 121.944 1.763 . . . . 0.0 111.099 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.726 ' HB2' HD13 ' A' ' 16' ' ' LEU . 0.4 OUTLIER -73.75 -41.93 61.8 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.104 178.94 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.692 HD12 HD12 ' A' ' 31' ' ' LEU . 7.2 tp -76.84 -17.97 58.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.155 -0.93 . . . . 0.0 109.492 178.478 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -70.65 -32.36 69.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.619 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.431 ' OG ' HG22 ' A' ' 38' ' ' ILE . 23.3 t -65.93 -27.09 67.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.188 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.692 HD12 HD12 ' A' ' 28' ' ' LEU . 69.8 mt -66.52 -9.91 39.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.859 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 43.3 t -93.88 16.89 13.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.1 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -100.58 139.42 36.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.931 0.396 . . . . 0.0 111.144 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.69 -16.95 64.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.328 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -78.9 127.51 32.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.845 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -82.41 -27.39 32.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.132 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -62.96 -48.09 80.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.856 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.431 HG22 ' OG ' ' A' ' 30' ' ' SER . 62.0 mt -73.07 -44.36 56.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.015 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.675 ' HG3' HD23 ' A' ' 31' ' ' LEU . 42.8 ttp180 -59.51 -27.5 66.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.821 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.83 -58.43 14.63 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.499 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.52 -42.72 67.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.673 0.273 . . . . 0.0 111.519 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.428 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.97 -56.16 24.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.856 0.36 . . . . 0.0 111.059 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.424 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -61.19 -31.4 71.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.256 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -69.93 -34.93 74.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.694 -0.684 . . . . 0.0 112.736 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.535 HG21 ' HB3' ' A' ' 13' ' ' SER . 26.1 mm -98.93 -19.47 5.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.858 0.361 . . . . 0.0 111.843 -178.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.642 ' HA ' HD21 ' A' ' 27' ' ' LEU . 5.8 tt -57.23 -36.63 52.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.932 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.584 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -76.69 -12.55 84.36 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.457 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -68.77 -21.17 64.37 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -83.85 -36.22 23.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.62 0.248 . . . . 0.0 111.249 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.562 ' HG3' HG12 ' A' ' 80' ' ' ILE . 18.8 mp0 68.38 55.81 0.5 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.123 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.455 ' O ' HG23 ' A' ' 55' ' ' VAL . 7.5 m-20 -127.79 -178.28 4.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.02 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.36 -38.44 91.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.954 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -65.7 -12.08 50.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.052 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.9 7.51 32.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.051 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 51' ' ' ASP . 86.1 t -91.37 -59.28 3.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.412 -178.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.44 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 22.5 tt0 -60.09 -49.4 91.17 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.44 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 83.1 Cg_exo -42.56 -52.78 4.2 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.334 2.023 . . . . 0.0 112.86 -179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.528 HD22 ' HA ' ' A' ' 73' ' ' ALA . 12.0 mt -59.81 -34.76 73.47 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.741 -179.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 55' ' ' VAL . 51.3 mm -63.44 -59.89 3.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.105 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.83 -6.37 37.44 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.347 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.698 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -89.42 -37.13 15.04 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.478 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.534 HD13 HD22 ' A' ' 92' ' ' LEU . 5.9 mt -62.97 -9.64 10.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.492 . . . . 0.0 110.651 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -112.48 -12.61 13.47 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.995 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.438 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.0 t0 -61.03 -30.05 70.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.256 0.55 . . . . 0.0 110.668 179.659 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.442 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 38.5 m-20 48.58 30.62 2.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.698 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.521 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 18.4 t -83.82 -5.66 59.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.717 0.294 . . . . 0.0 111.118 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.12 -80.55 1.2 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.279 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -67.52 -43.8 79.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.123 0.487 . . . . 0.0 109.824 179.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.698 HG12 ' HG ' ' A' ' 61' ' ' LEU . 42.3 t -73.45 -38.53 53.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.576 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.442 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 4.8 tmm_? -72.55 -62.62 1.38 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.09 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.2 t -51.99 -27.76 14.55 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.865 0.364 . . . . 0.0 110.813 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.49 -45.76 95.02 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.097 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.528 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -59.89 -45.26 93.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.945 0.402 . . . . 0.0 110.49 179.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.567 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.84 -24.68 67.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.571 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 ttt85 -83.64 -39.01 20.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.333 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.584 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 51.5 m -66.66 -35.82 81.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.01 -179.168 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.52 HD22 HG13 ' A' ' 85' ' ' VAL . 77.7 mt -55.5 -60.12 3.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.737 0.303 . . . . 0.0 111.226 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -53.98 -29.38 42.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.952 0.406 . . . . 0.0 110.289 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 76' ' ' SER . 52.5 mt-30 -70.41 -38.76 74.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.292 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.562 HG12 ' HG3' ' A' ' 50' ' ' GLN . 67.8 mt -75.89 -61.08 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.149 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.522 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 57.99 110.64 0.01 OUTLIER Glycine 0 C--N 1.332 0.312 0 C-N-CA 121.154 -0.546 . . . . 0.0 113.207 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.95 -171.36 37.0 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.769 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -62.56 -40.35 96.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.844 0.354 . . . . 0.0 110.632 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.404 ' CD ' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -58.48 -43.81 89.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.448 179.81 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.522 HG21 ' N ' ' A' ' 81' ' ' GLY . 2.2 t -70.94 -27.58 30.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.589 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HA ' ' SD ' ' A' ' 89' ' ' MET . 0.0 OUTLIER -55.9 -31.44 62.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.804 -179.697 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.52 -19.62 30.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.818 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.87 -50.94 53.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.572 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.405 ' SD ' ' HA ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -72.17 -28.64 63.35 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.815 0.341 . . . . 0.0 110.883 -179.566 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -69.59 -33.03 72.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.801 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -80.66 -25.4 38.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.088 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.708 HD21 ' O ' ' A' ' 100' ' ' ALA . 3.9 tp -86.71 -31.27 21.1 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.93 -26.48 62.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.713 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -79.97 -29.1 39.52 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 36.3 p -110.59 25.88 11.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.982 178.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.516 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -47.14 108.64 0.31 Allowed Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.62 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.5 p -142.7 130.51 21.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.924 0.393 . . . . 0.0 111.241 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.58 -141.37 47.72 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.084 -0.579 . . . . 0.0 113.349 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.459 ' O ' HG23 ' A' ' 103' ' ' VAL . 28.0 t80 -68.35 -27.26 66.1 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 122.465 0.306 . . . . 0.0 111.68 -179.396 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.708 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -54.52 -47.71 72.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.878 0.37 . . . . 0.0 111.738 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.516 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 45.9 ttp180 -56.41 -59.97 4.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.802 -179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -45.57 -25.76 0.5 Allowed 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.953 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.585 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 52.6 t -74.68 -56.51 8.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.608 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.534 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -53.84 -47.25 71.14 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.556 ' HA ' HD12 ' A' ' 108' ' ' LEU . 48.8 t -65.48 -55.52 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -62.72 -43.74 98.03 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.416 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 31.0 t80 -60.51 -27.56 67.7 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 120.889 0.376 . . . . 0.0 111.527 -178.374 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.556 HD12 ' HA ' ' A' ' 105' ' ' VAL . 9.9 mt -56.58 -21.51 27.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.537 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -77.06 4.43 10.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.582 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 5.2 m -111.38 -75.76 0.61 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.749 0.309 . . . . 0.0 111.051 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.819 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.5 mtt . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.843 0.354 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.26 21.61 8.36 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.446 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -152.01 136.46 16.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.874 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 59.09 14.06 3.26 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.973 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -142.51 -45.49 0.32 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.859 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt 63.27 -79.15 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.811 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 2.2 p-90 -134.26 115.94 14.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.15 0.5 . . . . 0.0 110.797 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.498 HG23 ' HG3' ' A' ' 9' ' ' ARG . 30.5 m -133.96 -33.36 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.299 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.553 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -164.55 -1.44 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.715 179.742 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.49 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 48.4 ttp180 -62.77 108.61 1.21 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 178.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 5.9 m-20 70.57 11.67 7.31 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.46 -179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.553 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 55.8 t -86.36 -67.1 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.491 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.425 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 35.1 t 73.23 -27.59 0.19 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.663 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.574 ' HB ' ' HB3' ' A' ' 17' ' ' SER . 79.1 p -80.91 139.5 35.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.677 0.275 . . . . 0.0 110.807 179.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.82 -67.8 0.83 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.453 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.1 pt? -86.17 -21.02 27.75 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 -178.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.574 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 25.3 t -64.78 -52.79 55.03 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -178.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 17' ' ' SER . 53.3 ttp180 175.07 111.0 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.731 -179.517 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.592 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -133.47 -38.43 0.93 Allowed 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.623 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.448 ' N ' ' SD ' ' A' ' 19' ' ' MET . . . 152.97 -102.73 0.23 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.342 -0.933 . . . . 0.0 113.031 -179.337 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.484 ' HA ' ' HB2' ' A' ' 24' ' ' PHE . 4.2 p-10 -137.67 -23.46 1.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.669 0.271 . . . . 0.0 111.268 -179.277 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 23' ' ' ALA . 9.9 pt-20 -61.2 -42.2 98.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.295 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.592 ' HB3' ' HG2' ' A' ' 19' ' ' MET . . . -103.5 16.8 25.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.39 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.565 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.2 t80 -63.34 -46.91 84.43 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.841 0.353 . . . . 0.0 110.316 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' A' ' 27' ' ' LEU . 37.1 mt-10 -43.34 -54.24 10.04 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.501 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 53.7 Cg_exo -35.99 -31.05 0.08 OUTLIER 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.515 2.143 . . . . 0.0 112.011 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.495 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 75.2 mt -71.71 -57.55 4.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.132 178.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.561 HD22 HD12 ' A' ' 31' ' ' LEU . 3.4 tm? -55.5 -39.66 70.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.726 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -62.75 -29.37 70.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.336 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 29.1 t -64.53 -20.42 66.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.428 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.617 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 59.5 mt -69.63 -11.74 61.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.805 0.336 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.2 m -101.99 14.61 31.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.004 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -94.05 139.51 30.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.883 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.421 ' CD ' ' H ' ' A' ' 34' ' ' GLU . 2.9 mp0 -63.22 -17.9 62.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.8 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -77.2 155.68 32.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.139 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -110.83 -39.31 4.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.667 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -60.03 -34.24 73.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.976 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.1 mt -82.61 -42.98 18.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.265 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.617 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 40.6 ttm180 -58.66 -47.54 84.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.395 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.03 -56.23 26.3 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.687 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.36 -33.76 21.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.772 0.32 . . . . 0.0 111.224 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.81 -47.48 84.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.599 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -76.6 -23.69 53.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.156 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.2 m95 -61.13 -38.39 86.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.011 0.434 . . . . 0.0 110.588 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.0 mm -99.86 -18.71 6.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.267 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.599 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -50.09 -44.61 22.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.17 -178.882 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.419 ' N ' ' CG2' ' A' ' 46' ' ' ILE . . . -72.53 -14.68 77.48 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.617 -0.801 . . . . 0.0 113.04 -179.301 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -70.69 -10.6 59.78 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.552 0.205 . . . . 0.0 111.552 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -92.75 -26.05 17.92 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.636 ' HG3' HG12 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 62.51 51.03 3.38 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.942 0.401 . . . . 0.0 111.123 -179.849 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -127.17 171.28 11.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.99 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.75 -36.56 83.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.794 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -66.61 -9.61 37.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.771 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.565 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -100.99 3.86 41.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.648 -179.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 47.6 t -92.06 -53.23 9.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.246 -179.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.558 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 12.7 tt0 -60.15 -51.21 81.98 Favored Pre-proline 0 CA--C 1.533 0.289 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -178.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 82.8 Cg_exo -46.58 -37.31 20.08 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.332 2.021 . . . . 0.0 112.649 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.466 ' HB3' HD11 ' A' ' 77' ' ' LEU . 48.9 mt -65.77 -40.55 92.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.065 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.459 HD11 ' HA ' ' A' ' 88' ' ' ALA . 46.7 mm -52.77 -54.38 16.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.294 -0.412 . . . . 0.0 112.08 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.82 74.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.042 -178.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.786 HD23 ' H ' ' A' ' 73' ' ' ALA . 0.3 OUTLIER -64.52 -37.54 87.91 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.284 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.507 ' HB3' HD22 ' A' ' 92' ' ' LEU . 34.9 mt -59.72 -13.73 11.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.306 0.574 . . . . 0.0 110.104 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -112.51 -13.43 13.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.241 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.477 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.6 OUTLIER -61.25 93.99 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.759 179.639 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -75.04 33.95 0.1 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.083 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.474 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 10.8 t -79.36 -27.11 41.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.972 0.415 . . . . 0.0 110.404 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.74 -110.12 1.13 Allowed Glycine 0 N--CA 1.453 -0.186 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.097 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -54.68 -25.46 27.31 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.596 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.3 t -64.72 -47.28 89.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.047 178.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.408 ' NH1' ' HB3' ' A' ' 99' ' ' PHE . 1.6 ttm180 -54.58 -54.44 41.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.948 0.404 . . . . 0.0 110.423 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 80.7 p -67.24 -16.59 64.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.071 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.565 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -52.53 -67.55 2.02 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.519 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.786 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -59.24 -36.51 75.6 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.538 0.209 . . . . 0.0 111.173 179.244 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -45.35 -56.38 5.01 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.574 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 72' ' ' GLY . 0.0 OUTLIER -70.2 -26.73 64.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.144 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.629 ' HA ' HE21 ' A' ' 79' ' ' GLN . 51.8 m -64.77 -39.27 93.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.74 0.305 . . . . 0.0 111.032 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.466 HD11 ' HB3' ' A' ' 58' ' ' LEU . 4.8 mp -61.08 -60.45 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.873 0.368 . . . . 0.0 110.55 179.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -57.21 -19.93 23.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.636 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.629 HE21 ' HA ' ' A' ' 76' ' ' SER . 3.3 tt0 -68.08 -56.99 6.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.432 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.656 ' HB ' HG21 ' A' ' 85' ' ' VAL . 82.7 mt -64.99 -60.59 2.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.143 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.12 102.37 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.451 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 174.83 -174.6 46.76 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.673 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -68.5 -37.03 79.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.872 0.368 . . . . 0.0 110.88 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.49 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.91 -46.19 90.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.528 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.656 HG21 ' HB ' ' A' ' 80' ' ' ILE . 21.3 t -70.88 -25.14 25.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.147 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -58.42 -35.01 71.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.55 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.33 -21.85 48.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.386 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.459 ' HA ' HD11 ' A' ' 59' ' ' ILE . . . -71.4 -41.86 69.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.287 179.545 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.672 ' HE1' HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -72.26 -35.0 68.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.136 179.6 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -60.43 -44.88 95.33 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.513 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' A' ' 91' ' ' LYS . 3.8 tmtp? -62.34 -32.53 73.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.838 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.698 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.6 OUTLIER -83.06 -25.48 32.04 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.73 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.01 -18.92 64.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.332 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -80.3 -31.04 38.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.873 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.4 p -115.83 22.13 13.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.56 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.431 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.27 119.09 11.78 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.255 -0.884 . . . . 0.0 113.339 -178.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 26.0 m -143.83 129.11 18.83 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.744 0.306 . . . . 0.0 110.804 178.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.24 -136.34 51.05 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.861 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.495 ' O ' HG23 ' A' ' 103' ' ' VAL . 64.3 t80 -60.86 -38.01 84.1 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.797 0.332 . . . . 0.0 110.711 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.553 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.71 -41.59 56.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.879 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.431 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 38.6 ttt180 -68.91 -59.54 2.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.793 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -46.29 -23.97 0.42 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.917 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 99' ' ' PHE . 24.9 t -66.16 -60.31 2.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.276 179.488 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.698 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.48 -52.0 67.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.968 0.413 . . . . 0.0 111.774 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 61.7 t -57.69 -61.72 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.496 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -58.62 -30.06 66.98 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -59.71 -27.05 66.12 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.017 0.437 . . . . 0.0 110.49 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.672 HD11 ' HE1' ' A' ' 89' ' ' MET . 18.2 mt -59.99 -29.3 68.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.448 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -52.45 -25.75 10.91 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.152 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.8 p -101.91 -50.67 3.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.037 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.896 -179.817 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 mpp? . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.762 0.315 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.37 -169.44 1.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.262 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -87.62 -7.08 57.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.722 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -84.43 19.19 1.99 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.782 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -79.58 17.15 0.92 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.177 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -93.68 -14.29 26.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.314 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -91.81 18.86 7.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.721 0.296 . . . . 0.0 111.316 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.1 p -102.93 152.27 5.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.316 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.531 ' H ' ' HB3' ' A' ' 21' ' ' ASP . 13.1 ptp180 43.32 24.94 0.06 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.368 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.406 ' C ' ' H ' ' A' ' 12' ' ' VAL . 20.5 mmm180 -71.56 103.84 3.11 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.6 t70 71.07 -10.32 0.77 Allowed 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.211 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.406 ' H ' ' C ' ' A' ' 10' ' ' ARG . 9.7 t -117.0 157.69 17.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.032 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.403 ' N ' HG12 ' A' ' 12' ' ' VAL . 55.3 m -156.88 13.11 0.26 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.279 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.657 HG23 ' HA ' ' A' ' 18' ' ' ARG . 88.2 m -150.34 92.52 1.88 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.231 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.814 ' HB3' ' HB3' ' A' ' 23' ' ' ALA . . . -95.96 -73.07 0.61 Allowed 'General case' 0 C--O 1.232 0.15 0 C-N-CA 120.371 -0.532 . . . . 0.0 111.523 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.459 ' H ' ' HB3' ' A' ' 23' ' ' ALA . 9.8 tt -90.75 -68.63 0.78 Allowed 'General case' 0 C--O 1.231 0.104 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.445 178.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.48 ' O ' ' HB2' ' A' ' 18' ' ' ARG . 47.5 t -91.89 -53.4 4.29 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.241 178.431 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.657 ' HA ' HG23 ' A' ' 14' ' ' THR . 66.3 ttt180 171.74 64.08 0.0 OUTLIER 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.752 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.568 ' SD ' ' HB2' ' A' ' 23' ' ' ALA . 8.3 mtp -125.28 -43.68 1.92 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.402 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.65 ' H ' ' H ' ' A' ' 15' ' ' ALA . . . 77.26 100.39 0.17 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.92 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.531 ' HB3' ' H ' ' A' ' 9' ' ' ARG . 15.8 t70 70.56 -21.63 0.19 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 122.606 0.363 . . . . 0.0 111.816 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.47 ' H ' ' C ' ' A' ' 20' ' ' GLY . 27.4 tt0 -85.65 -24.86 26.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.975 0.417 . . . . 0.0 110.405 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.814 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . . . -95.93 9.24 41.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.164 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.524 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 3.0 t80 -63.35 -46.45 86.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.925 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.436 ' O ' ' N ' ' A' ' 27' ' ' LEU . 6.4 mm-40 -63.4 -51.95 64.1 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.675 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.508 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 95.8 Cg_exo -42.93 -19.12 0.12 Allowed 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 122.427 2.085 . . . . 0.0 111.926 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.521 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.2 mt -85.66 -52.39 5.83 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.159 178.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.598 HD12 HD12 ' A' ' 31' ' ' LEU . 52.5 tp -59.29 -33.65 71.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.728 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 26' ' ' PRO . 8.6 pt-20 -61.99 -28.42 69.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.843 0.354 . . . . 0.0 110.745 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.402 ' HB3' ' HB2' ' A' ' 42' ' ' ALA . 32.8 t -63.69 -21.39 66.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.516 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.643 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 42.0 mt -67.5 -6.74 21.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.696 0.284 . . . . 0.0 111.047 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 91.5 p -113.94 20.45 15.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.318 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.04 150.42 21.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.87 0.367 . . . . 0.0 111.184 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.95 -29.18 69.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.048 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -78.29 160.69 27.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.926 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.9 p90 -111.15 -39.6 4.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.177 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -59.68 -34.65 73.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.933 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.7 mt -76.86 -42.52 33.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.683 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.643 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 27.5 ttm180 -54.16 -32.18 54.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.71 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.4 -47.07 65.19 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.232 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.3 -24.81 12.63 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.759 0.314 . . . . 0.0 111.138 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.414 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -68.58 -57.42 5.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.388 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.82 -17.5 62.15 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.24 0.543 . . . . 0.0 110.582 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -46.79 87.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.183 -179.203 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 12.6 mt -98.53 -24.32 4.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.414 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 5.1 tt -56.44 -24.59 19.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.685 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 76' ' ' SER . . . -74.44 -27.43 65.63 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.905 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -59.84 -22.31 62.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.646 0.26 . . . . 0.0 111.471 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -105.07 107.73 18.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.425 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.754 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.4 mp0 -65.91 78.87 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.139 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -127.61 153.86 45.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.514 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.613 ' O ' HG22 ' A' ' 55' ' ' VAL . 13.5 pt-20 -64.91 -28.44 69.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.443 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -69.33 -12.12 61.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.363 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.524 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -104.37 21.94 15.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 52' ' ' GLU . 32.7 m -91.75 -57.88 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.717 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.581 ' N ' HG23 ' A' ' 55' ' ' VAL . 28.7 tt0 -60.31 -50.52 85.47 Favored Pre-proline 0 CA--C 1.533 0.319 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.549 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.5 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 95.1 Cg_exo -40.37 -52.03 3.15 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.495 2.13 . . . . 0.0 112.99 -179.539 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.451 HD22 ' OG ' ' A' ' 76' ' ' SER . 4.1 mt -62.97 -46.67 86.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.717 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 55' ' ' VAL . 47.6 mm -56.82 -56.24 15.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -70.09 -16.99 63.2 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.734 ' HG ' HG13 ' A' ' 69' ' ' VAL . 11.4 tp -90.47 -40.7 11.86 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -177.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.498 ' HA ' ' HA ' ' A' ' 70' ' ' ARG . 2.9 pp -64.6 -9.76 21.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.76 0.314 . . . . 0.0 111.657 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.479 ' HG3' HD12 ' A' ' 62' ' ' LEU . 24.0 mt-10 -98.81 -11.87 21.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.553 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.421 ' HB3' ' CG1' ' A' ' 69' ' ' VAL . 7.0 t70 -62.58 -30.64 71.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.175 0.512 . . . . 0.0 111.339 -179.077 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.683 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 12.3 m-20 63.6 23.94 13.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.935 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.418 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 25.8 t -83.68 1.37 42.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.603 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.625 ' H ' ' HG2' ' A' ' 70' ' ' ARG . . . 84.8 -94.17 1.86 Allowed Glycine 0 C--O 1.227 -0.311 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.671 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -49.33 -44.88 44.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.41 0.624 . . . . 0.0 110.066 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.734 HG13 ' HG ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -63.4 -44.76 99.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.076 -0.966 . . . . 0.0 112.271 -178.976 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.683 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 13.6 ptt180 -78.44 -22.48 47.56 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 67.6 m -66.85 -52.11 47.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.588 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -52.73 -47.73 57.9 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.013 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.43 ' HB1' ' O ' ' A' ' 58' ' ' LEU . . . -56.56 -39.27 73.17 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.019 0.438 . . . . 0.0 110.882 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.87 -54.2 45.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.782 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 71' ' ' SER . 6.6 ptp180 -70.99 -27.26 63.57 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.451 ' OG ' HD22 ' A' ' 58' ' ' LEU . 32.0 p -63.33 -40.04 96.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.454 0.169 . . . . 0.0 111.449 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 93.1 mt -61.43 -59.83 4.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.719 0.295 . . . . 0.0 110.572 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.402 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 38.4 tt0 -55.16 -25.73 34.1 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.095 0.474 . . . . 0.0 110.052 178.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -69.46 -45.0 70.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.223 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.754 HG23 ' HG3' ' A' ' 50' ' ' GLN . 90.4 mt -64.16 -61.13 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.712 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.46 124.53 0.01 OUTLIER Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.008 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 150.65 165.17 12.48 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.914 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -58.13 -22.27 50.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.863 0.363 . . . . 0.0 110.76 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.692 ' HD3' HG23 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -74.06 -36.67 64.37 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.895 -179.693 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.692 HG23 ' HD3' ' A' ' 84' ' ' ARG . 13.7 t -70.77 -28.59 34.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.013 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 86' ' ' ARG . 18.1 tpt85 -51.39 -29.52 15.96 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.215 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.12 -31.21 23.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.098 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.47 -56.66 12.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.592 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.515 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 3.2 ppp? -64.21 -24.87 67.83 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.563 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.433 ' N ' ' SD ' ' A' ' 89' ' ' MET . 6.0 mm-40 -68.8 -31.22 70.07 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.437 ' O ' ' HD3' ' A' ' 91' ' ' LYS . 1.8 tmtp? -71.53 -37.24 71.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.358 179.24 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.589 HD21 ' O ' ' A' ' 100' ' ' ALA . 0.1 OUTLIER -82.2 -26.87 32.97 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.63 -26.32 66.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.192 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -80.17 -26.81 39.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.719 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.8 p -109.96 19.24 19.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.576 178.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.521 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -52.93 111.71 1.82 Allowed Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.276 -0.874 . . . . 0.0 113.101 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.2 t -142.85 130.85 21.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.838 0.352 . . . . 0.0 110.873 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.44 -126.6 35.89 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.729 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -80.58 -29.84 36.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.882 0.372 . . . . 0.0 110.855 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.589 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.57 -34.7 38.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.677 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.521 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 42.4 ttt180 -72.04 -56.68 5.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.738 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -45.95 -23.15 0.26 Allowed 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.769 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 53.9 t -69.92 -57.66 7.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.593 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.515 ' HB1' ' HB2' ' A' ' 89' ' ' MET . . . -59.47 -55.27 36.75 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.519 HG13 ' N ' ' A' ' 106' ' ' ASN . 7.0 p -62.64 -55.72 22.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.519 ' N ' HG13 ' A' ' 105' ' ' VAL . 27.1 t-20 -56.95 -31.23 64.77 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -178.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.416 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 7.0 t80 -60.4 -33.4 72.43 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.103 0.478 . . . . 0.0 110.635 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -54.38 -13.3 0.87 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.788 -179.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -54.2 -20.68 7.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.202 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.6 p -110.82 -69.64 0.86 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.351 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 60.9 m80 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.92 -179.929 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.767 0.318 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.61 -40.76 6.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.996 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.3 177.65 5.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.981 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 58.26 23.08 9.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.946 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -129.96 -170.03 2.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.855 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm 63.64 18.18 10.92 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.486 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 9.3 p-90 -135.36 7.36 3.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.82 0.343 . . . . 0.0 110.931 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.2 p -66.69 -35.7 75.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.197 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 -121.42 -36.1 3.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.989 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.652 ' HE ' ' H ' ' A' ' 11' ' ' ASP . 6.9 tpm_? -64.19 139.44 58.77 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.652 ' H ' ' HE ' ' A' ' 10' ' ' ARG . 16.9 t70 77.78 -28.25 0.17 Allowed 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.504 0.503 . . . . 0.0 111.752 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.18 154.59 4.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.043 0.449 . . . . 0.0 111.826 -179.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.3 t -156.88 -40.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.315 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.494 HG23 ' H ' ' A' ' 18' ' ' ARG . 0.9 OUTLIER -64.43 168.47 5.74 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.634 179.334 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.32 -67.97 0.82 Allowed 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.593 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.4 pt? -84.91 -39.0 18.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.349 0.499 . . . . 0.0 112.349 -178.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.467 ' HB3' HG21 ' A' ' 14' ' ' THR . 38.9 t -54.89 -51.77 64.97 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.101 -0.24 . . . . 0.0 110.947 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.494 ' H ' HG23 ' A' ' 14' ' ' THR . 99.1 mtt180 -151.92 114.8 4.65 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.996 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.444 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -128.46 -43.52 1.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.768 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 97.11 74.9 1.21 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.829 -0.7 . . . . 0.0 113.05 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 62.17 8.65 2.76 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -101.12 -44.69 5.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.922 0.391 . . . . 0.0 110.804 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.469 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . -106.44 9.98 31.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.831 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.427 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 3.8 t80 -61.62 -42.15 98.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.016 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -59.4 -54.55 54.94 Favored Pre-proline 0 C--N 1.33 -0.279 0 C-N-CA 120.629 -0.429 . . . . 0.0 111.384 -179.585 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 52.2 Cg_exo -48.28 -26.39 8.28 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.886 1.724 . . . . 0.0 110.86 178.714 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.538 HD21 HG13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -80.14 -36.41 35.26 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.618 179.472 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.717 HD12 HD12 ' A' ' 31' ' ' LEU . 9.4 tp -76.99 -24.61 52.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.446 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -68.94 -42.66 76.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.897 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.6 m -66.56 -12.87 59.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.569 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.717 HD12 HD12 ' A' ' 28' ' ' LEU . 81.1 mt -68.9 -7.16 32.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.687 0.28 . . . . 0.0 111.252 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.2 p -110.16 8.04 23.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.035 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.606 ' ND2' ' HB ' ' A' ' 38' ' ' ILE . 20.2 p-10 -67.58 150.32 48.95 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.923 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -64.12 -31.16 72.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.325 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.27 152.27 36.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.075 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 13.4 p90 -100.61 -33.33 10.35 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.161 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -58.79 -50.91 72.18 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.428 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.606 ' HB ' ' ND2' ' A' ' 33' ' ' ASN . 77.8 mt -63.22 -39.76 86.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.368 179.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.535 ' CZ ' HG11 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -62.3 -23.47 66.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.158 179.504 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.09 -59.61 4.57 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.032 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.6 -36.17 4.54 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.829 0.347 . . . . 0.0 110.78 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.409 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.53 -48.97 79.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.261 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.428 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -66.19 -30.64 71.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.042 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.0 m95 -68.31 -32.44 72.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.506 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.5 mt -98.93 -19.88 5.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.784 0.326 . . . . 0.0 111.528 -179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.538 HG13 HD21 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -60.35 -40.25 83.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.866 -178.908 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.07 -23.35 78.11 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.639 -0.791 . . . . 0.0 113.078 -179.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -70.75 2.08 4.62 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -101.22 -28.15 12.82 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.539 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.458 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.3 OUTLIER 57.26 31.48 20.17 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.117 0.484 . . . . 0.0 110.897 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -102.55 162.69 12.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.137 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -61.76 -33.49 74.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 110.574 179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.502 ' NE ' HD22 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -68.24 -16.68 64.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.354 179.721 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -96.75 -5.83 37.66 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.664 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.15 -46.29 34.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.535 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.531 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 34.6 tt0 -60.37 -50.4 85.97 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 95.0 Cg_exo -44.15 -53.85 4.38 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.549 2.166 . . . . 0.0 113.016 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.656 HD13 HD22 ' A' ' 77' ' ' LEU . 9.6 mt -54.5 -37.64 65.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.442 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.1 mm -59.67 -61.04 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -70.62 -12.21 61.42 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.782 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -89.39 -41.53 12.06 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -177.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.79 HD13 HD22 ' A' ' 92' ' ' LEU . 12.3 mt -64.49 -9.89 21.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.115 0.483 . . . . 0.0 110.997 -178.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -116.18 -12.11 11.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.703 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.471 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -61.27 -32.91 72.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.346 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.563 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 17.8 m-20 59.13 29.35 18.89 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.301 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.484 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 11.8 m -79.81 10.09 4.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.728 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 67.84 -82.29 0.17 Allowed Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.427 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -48.79 78.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.021 0.438 . . . . 0.0 110.156 179.459 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.782 HG12 ' HG ' ' A' ' 61' ' ' LEU . 2.1 t -72.67 -44.26 60.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.675 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.563 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 3.7 tmm_? -59.03 -48.34 81.96 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.849 0.357 . . . . 0.0 110.444 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.415 ' HB3' HH12 ' A' ' 75' ' ' ARG . 72.7 m -67.1 -36.77 82.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.787 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.05 -30.0 60.07 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.676 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.423 ' O ' HD23 ' A' ' 77' ' ' LEU . . . -80.73 -40.23 25.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.646 0.26 . . . . 0.0 110.846 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.514 ' HA ' HG11 ' A' ' 103' ' ' VAL . . . -49.83 -45.36 50.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.732 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.415 HH12 ' HB3' ' A' ' 71' ' ' SER . 3.7 ptp85 -72.24 -25.61 61.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.579 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.409 ' HB2' HD22 ' A' ' 58' ' ' LEU . 41.9 m -67.19 -35.54 79.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.763 -179.397 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.77 HD21 HD11 ' A' ' 62' ' ' LEU . 4.0 mm? -55.55 -59.95 4.11 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.837 0.351 . . . . 0.0 110.724 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -64.18 -25.76 68.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.968 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -61.54 -43.98 97.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.212 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.458 HG12 ' HG3' ' A' ' 50' ' ' GLN . 64.8 mt -70.22 -60.86 2.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.271 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.417 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 66.59 108.37 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.788 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.504 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 152.29 -176.26 30.62 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.653 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -71.55 -31.85 67.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.339 . . . . 0.0 110.971 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.567 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.09 -54.03 49.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.567 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 9.3 p -70.65 -24.42 25.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.135 0.493 . . . . 0.0 110.816 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -57.31 -26.82 61.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.118 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.27 -26.93 47.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.987 0.422 . . . . 0.0 110.674 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.25 -46.56 60.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.305 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.495 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.92 -33.66 70.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.867 0.365 . . . . 0.0 110.566 179.837 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.4 -41.34 98.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.428 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -70.72 -24.49 62.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.025 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.79 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -84.86 -30.08 24.76 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.08 67.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.619 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.33 -25.78 39.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.343 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.3 p -117.1 21.39 13.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.33 179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -55.52 119.77 15.31 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 114.946 -1.024 . . . . 0.0 113.46 -178.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 29.8 m -139.76 129.87 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.556 -0.322 . . . . 0.0 110.361 179.004 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.73 -143.47 48.65 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.757 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -63.9 -30.34 71.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.756 0.312 . . . . 0.0 111.527 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.599 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -54.15 -34.38 60.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.117 -179.163 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.411 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 60.3 ttt180 -70.86 -58.95 3.09 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 20.9 ttmm -45.84 -25.45 0.52 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.171 0.51 . . . . 0.0 111.082 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.514 HG11 ' HA ' ' A' ' 74' ' ' ALA . 37.7 t -67.41 -48.29 77.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.375 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.619 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -64.85 -59.31 4.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.567 0.699 . . . . 0.0 112.251 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.463 HG22 ' H ' ' A' ' 105' ' ' VAL . 0.0 OUTLIER -59.39 -63.01 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 114.731 -1.122 . . . . 0.0 113.973 -177.955 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.449 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 10.0 m120 -55.53 -25.59 38.37 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.417 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 2.1 t80 -59.0 -35.85 73.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.039 0.447 . . . . 0.0 109.927 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 46.3 mt -52.57 -22.53 5.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.717 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -64.25 -6.29 6.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.541 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.2 m -117.12 -47.6 2.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.742 0.306 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 76.8 m80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.93 179.701 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.0 mtt . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.615 0.245 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.46 -83.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.574 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -110.19 -174.76 2.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.812 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 61.8 -83.87 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.206 179.879 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -78.84 98.16 6.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.862 0.363 . . . . 0.0 110.806 -179.953 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.478 ' HB2' ' NZ ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -158.31 -23.92 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.784 179.825 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.568 ' HA ' ' HG3' ' A' ' 10' ' ' ARG . 36.9 p-90 -88.03 16.5 5.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.763 179.668 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.409 HG12 ' O ' ' A' ' 8' ' ' VAL . 45.7 t -96.72 -9.16 9.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.182 -179.838 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.653 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 38.8 mtt180 -129.49 15.19 6.04 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.561 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.568 ' HG3' ' HA ' ' A' ' 7' ' ' TRP . 96.4 mtt180 -63.26 103.89 0.54 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.332 -1.359 . . . . 0.0 107.332 177.468 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 64.63 31.27 12.24 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -176.978 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.653 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 3.6 p -40.07 143.88 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.338 -179.448 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 t -177.32 -85.92 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.962 -178.633 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 70.2 p -98.13 101.56 13.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.013 179.318 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.455 ' HA ' ' HG3' ' A' ' 19' ' ' MET . . . -88.29 -68.62 0.75 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.301 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.47 ' HA ' ' HB1' ' A' ' 23' ' ' ALA . 1.8 pt? -60.28 -13.84 14.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.705 -178.703 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.6 t -67.46 -50.61 58.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.681 0.277 . . . . 0.0 110.867 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -171.13 93.22 0.17 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.252 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.455 ' HG3' ' HA ' ' A' ' 15' ' ' ALA . 20.1 mmt -133.48 -43.5 0.84 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.155 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 88.73 -34.49 3.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.525 -179.771 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -141.14 -40.04 0.4 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.794 0.33 . . . . 0.0 110.819 -179.975 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -68.34 -6.95 27.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.783 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.47 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -104.75 -10.55 17.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.27 -179.795 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.415 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.7 t80 -61.87 -48.76 79.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.595 179.582 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.4 -55.29 36.76 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.735 179.644 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 40.4 Cg_exo -50.56 -21.33 7.54 Favored 'Trans proline' 0 C--N 1.359 1.106 0 C-N-CA 121.838 1.692 . . . . 0.0 110.432 179.058 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.63 HD21 HG13 ' A' ' 46' ' ' ILE . 1.3 tp -86.32 -38.11 17.82 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.138 -1.392 . . . . 0.0 109.966 179.768 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.696 HD12 HD12 ' A' ' 31' ' ' LEU . 15.1 tp -74.58 -21.89 59.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.41 179.208 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.53 -35.23 75.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.878 -179.717 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.0 m -63.71 -24.48 67.79 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.514 -179.665 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.696 HD12 HD12 ' A' ' 28' ' ' LEU . 90.1 mt -67.46 -16.59 64.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.12 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.4 m -100.27 12.16 37.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.793 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -85.36 144.19 28.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.057 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -67.53 -29.42 68.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.035 -179.921 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -75.93 144.92 40.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.055 -179.831 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.516 ' HB2' HG21 ' A' ' 69' ' ' VAL . 58.1 p-90 -89.39 -31.93 17.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.748 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.413 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 4.9 tmt_? -58.96 -35.43 73.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.654 179.616 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 mm -82.74 -47.02 18.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.542 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.514 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 51.3 ttp180 -57.43 -42.07 81.67 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.772 -179.273 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -55.95 -63.08 5.62 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.739 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.7 -25.98 0.84 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.65 0.262 . . . . 0.0 111.596 -179.821 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 39' ' ' ARG . . . -64.11 -57.0 10.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.794 0.33 . . . . 0.0 110.397 179.529 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.95 -24.95 68.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.499 179.475 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.422 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 8.1 m95 -61.2 -44.91 96.54 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.154 -179.489 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.8 mm -98.78 -19.05 6.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -178.886 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.63 HG13 HD21 ' A' ' 27' ' ' LEU . 5.8 tt -56.43 -34.25 40.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -178.499 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.42 -19.02 79.73 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.567 -0.825 . . . . 0.0 113.184 -179.277 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -70.87 2.39 4.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.376 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -107.06 -18.43 13.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -179.545 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.677 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 55.97 56.54 5.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.807 0.336 . . . . 0.0 111.249 -179.679 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -127.61 161.16 29.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.023 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.433 ' HA ' HG23 ' A' ' 55' ' ' VAL . 13.1 pt-20 -65.86 -30.6 71.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.692 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.54 ' HD3' HD22 ' A' ' 28' ' ' LEU . 17.2 ttm180 -69.17 -10.89 59.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.69 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.415 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -106.3 3.17 27.34 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.066 -179.557 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.569 HG22 HH12 ' A' ' 84' ' ' ARG . 64.5 t -83.2 -55.09 7.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.173 -178.994 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.487 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 18.9 tt0 -59.17 -49.01 95.26 Favored Pre-proline 0 CA--C 1.532 0.271 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.69 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.487 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 90.4 Cg_exo -42.94 -32.33 2.63 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.484 2.123 . . . . 0.0 112.732 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.685 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 4.8 mt -73.35 -52.71 12.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.736 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 38.5 mm -49.25 -50.75 15.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.968 -179.503 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.99 -32.85 71.26 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -178.629 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.535 ' HG ' HG12 ' A' ' 69' ' ' VAL . 5.2 tp -89.82 -12.41 39.21 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.895 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.594 HD13 HD22 ' A' ' 92' ' ' LEU . 17.0 mt -72.97 -13.84 61.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.881 0.372 . . . . 0.0 111.1 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -116.03 9.78 14.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.101 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.07 -31.75 71.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.265 0.555 . . . . 0.0 110.931 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 23.3 m-20 51.9 25.14 2.88 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.237 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.9 t -86.22 -17.15 35.54 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.758 0.314 . . . . 0.0 110.825 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.76 -110.22 1.6 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.311 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.422 ' HD1' ' NE1' ' A' ' 44' ' ' TRP . 0.1 OUTLIER -60.33 -26.58 66.68 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.469 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.535 HG12 ' HG ' ' A' ' 61' ' ' LEU . 24.3 t -69.46 -30.04 44.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.628 178.685 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.463 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 57.5 ttp180 -78.38 -55.74 5.0 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.464 179.391 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.469 ' O ' ' HG3' ' A' ' 75' ' ' ARG . 46.2 m -62.37 -28.0 69.47 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.967 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.5 -59.98 9.79 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.583 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.685 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -60.68 -27.94 68.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.786 0.327 . . . . 0.0 110.911 179.984 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.549 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.9 -45.15 95.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.573 -179.775 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.519 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 28.5 mtp85 -62.2 -33.47 74.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.412 -179.578 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.8 m -50.74 -46.48 59.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.846 -178.358 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.612 ' H ' HD12 ' A' ' 77' ' ' LEU . 5.7 mp -56.96 -55.76 30.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.844 0.354 . . . . 0.0 110.133 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -59.1 -32.76 70.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.281 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 29.6 mt-30 -65.32 -30.74 71.62 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.803 0.335 . . . . 0.0 110.776 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.677 HG23 ' HG3' ' A' ' 50' ' ' GLN . 90.1 mt -90.06 -60.88 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.3 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.51 113.66 0.01 OUTLIER Glycine 0 C--N 1.331 0.27 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.016 179.754 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.03 174.89 30.39 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.629 179.851 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.3 -32.77 74.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.809 0.338 . . . . 0.0 111.004 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.698 HH11 HG13 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -61.48 -54.85 37.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.469 179.948 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.698 HG13 HH11 ' A' ' 84' ' ' ARG . 0.0 OUTLIER -70.72 -21.62 22.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.834 179.213 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -56.44 -27.79 57.68 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.712 179.921 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.62 -27.55 45.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.241 179.69 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.69 -47.08 79.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.666 179.497 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.499 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 3.0 ppp? -67.57 -25.91 66.02 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.76 0.314 . . . . 0.0 110.215 179.735 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.442 ' N ' ' SD ' ' A' ' 89' ' ' MET . 37.0 mt-10 -69.03 -39.27 79.32 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.707 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -69.46 -31.2 69.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.908 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.594 HD22 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -85.73 -24.29 26.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.096 -179.945 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.99 -28.76 70.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.68 179.391 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -80.34 -25.01 39.46 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.048 0.451 . . . . 0.0 110.011 179.627 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.0 p -111.99 17.48 19.63 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.393 179.215 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.436 ' HA3' ' CD ' ' A' ' 101' ' ' ARG . . . -55.76 121.5 23.4 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.887 -179.346 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.6 t -139.81 130.11 25.32 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.432 -0.384 . . . . 0.0 111.267 179.455 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 51.58 -113.23 2.24 Favored Glycine 0 C--N 1.33 0.215 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.743 179.893 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.473 ' O ' HG23 ' A' ' 103' ' ' VAL . 70.7 t80 -78.71 -33.32 46.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.756 0.312 . . . . 0.0 110.91 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.482 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.57 -39.46 64.83 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.61 -179.929 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.436 ' CD ' ' HA3' ' A' ' 96' ' ' GLY . 8.5 tpt180 -66.66 -61.28 2.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.677 0.275 . . . . 0.0 111.341 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -48.26 -26.78 2.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.884 -179.664 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.482 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 8.5 t -61.13 -52.7 58.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.022 179.53 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.499 ' HB1' ' HB2' ' A' ' 89' ' ' MET . . . -64.84 -59.81 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.124 -179.475 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 52.1 t -52.58 -63.03 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.934 -178.675 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -56.03 -33.94 65.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -178.844 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -61.08 -25.57 67.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.028 0.442 . . . . 0.0 111.067 -179.398 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.448 HD11 ' HE1' ' A' ' 89' ' ' MET . 81.1 mt -57.89 -21.53 43.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.735 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -96.29 7.04 47.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.77 -179.16 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 66.8 p -119.97 -16.46 8.63 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -179.125 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.066 -0.969 . . . . 0.0 110.81 -179.746 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptp . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 120.612 0.244 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.34 101.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.899 -179.656 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.2 t70 68.87 -2.75 1.63 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.962 -179.659 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -128.63 95.44 4.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.753 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 61.12 107.51 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.326 179.966 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -127.41 -15.53 5.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.602 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 19.7 p-90 -140.04 25.4 2.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.641 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.467 HG23 ' HG2' ' A' ' 22' ' ' GLU . 9.1 p -73.67 11.52 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.27 -179.744 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.573 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 73.3 ttt180 -154.05 -3.24 0.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.914 179.749 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -60.88 104.83 0.4 Allowed 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.601 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.6 t70 65.84 34.36 7.37 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -177.475 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.573 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 7.6 p -42.33 154.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.523 -179.195 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.423 ' N ' HG22 ' A' ' 12' ' ' VAL . 9.7 t -159.39 -158.38 0.66 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.858 -178.629 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.55 ' HB ' ' HB3' ' A' ' 17' ' ' SER . 1.6 m -52.34 170.62 0.06 Allowed 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.566 179.654 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.544 ' H ' HG22 ' A' ' 14' ' ' THR . . . -82.08 -68.65 0.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -178.415 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.489 HD22 ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -86.36 -13.3 46.85 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -178.164 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.55 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 47.3 t -51.78 -53.53 38.84 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.559 -178.916 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' A' ' 17' ' ' SER . 42.9 ttt180 174.37 96.64 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.114 0.259 . . . . 0.0 111.574 179.729 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 22.8 mtm -134.23 -9.63 2.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.827 0.346 . . . . 0.0 110.901 179.07 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 85.32 -114.86 4.04 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.462 179.982 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -66.97 -24.03 66.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.953 0.406 . . . . 0.0 110.888 179.959 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' HG2' HG23 ' A' ' 8' ' ' VAL . 6.8 mt-10 -82.23 -24.59 34.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.918 -179.544 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.407 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . -95.57 -11.53 27.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.582 -179.568 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.589 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.2 t80 -63.26 -44.64 94.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.038 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.35 -56.17 29.49 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.407 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 89.5 Cg_exo -45.15 -26.85 2.5 Favored 'Trans proline' 0 C--N 1.358 1.052 0 C-N-CA 122.022 1.815 . . . . 0.0 111.269 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.3 mt -71.21 -55.92 7.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.142 -0.936 . . . . 0.0 109.51 178.3 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.569 HD12 HD12 ' A' ' 31' ' ' LEU . 14.8 tp -63.64 -18.49 64.0 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.95 178.814 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -82.91 -30.17 28.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.66 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.474 ' OG ' HG22 ' A' ' 38' ' ' ILE . 44.2 t -65.09 -17.16 64.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.995 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.657 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 89.1 mt -66.28 -20.88 66.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.941 179.978 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.2 m -89.78 19.17 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.605 179.502 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -101.48 131.6 47.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.053 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -66.87 -11.32 55.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.469 -179.658 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -86.38 133.42 33.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.903 0.383 . . . . 0.0 111.329 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 53.8 p-90 -79.03 -32.1 44.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.366 179.423 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -64.97 -50.43 66.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.14 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.474 HG22 ' OG ' ' A' ' 30' ' ' SER . 71.5 mt -66.94 -51.7 51.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.228 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.657 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 32.1 ttm180 -58.59 -24.62 61.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.815 0.341 . . . . 0.0 110.707 -179.944 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.27 -57.55 7.43 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.48 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.17 -37.86 36.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.658 0.266 . . . . 0.0 111.415 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.63 -52.69 64.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.911 0.386 . . . . 0.0 110.758 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.446 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -66.07 -33.55 76.05 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.12 179.588 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -66.3 -28.92 69.06 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.432 -178.827 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 53.5 mt -100.09 -27.14 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.849 0.357 . . . . 0.0 111.567 -179.026 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.445 HD12 ' HB3' ' A' ' 27' ' ' LEU . 1.1 tt -58.39 -30.95 41.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.023 -178.943 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -68.38 -21.24 74.12 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.513 -179.299 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -70.57 -25.21 62.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.888 0.344 . . . . 0.0 111.9 -179.318 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -69.68 -35.22 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -179.45 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.62 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 41.3 mt-30 64.99 17.62 11.16 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.058 0.456 . . . . 0.0 110.354 -179.964 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -89.56 164.08 14.93 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.236 -179.702 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -62.9 -36.74 84.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.079 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -68.23 -9.21 45.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.712 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.434 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -102.6 -1.77 29.67 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.479 -179.615 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.6 t -87.57 -35.08 7.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.15 -179.761 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.535 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.6 tm-20 -60.41 -49.6 89.58 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.504 -179.679 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.535 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 71.7 Cg_exo -48.19 -50.48 11.94 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.041 1.827 . . . . 0.0 111.993 179.548 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 73' ' ' ALA . 11.0 mt -57.86 -30.22 65.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.777 -179.381 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 31.4 mm -62.43 -59.1 4.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -70.08 -36.09 74.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.744 0.307 . . . . 0.0 111.485 -179.423 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.671 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -54.6 -55.42 29.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.171 -179.176 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.725 HD13 HD22 ' A' ' 92' ' ' LEU . 16.7 mt -53.91 -12.25 0.54 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.721 0.296 . . . . 0.0 111.188 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -114.29 -15.46 12.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.375 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.1 -41.2 96.25 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.329 0.585 . . . . 0.0 111.256 -179.281 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.664 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 24.1 t70 61.11 28.25 17.97 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.778 -179.845 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.506 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 56.4 m -82.14 1.11 37.74 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.119 -179.334 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.59 -86.78 1.54 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.528 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -62.65 -44.06 97.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.04 0.448 . . . . 0.0 110.26 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.671 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.8 t -71.2 -39.93 73.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.158 -179.896 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.664 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 5.2 ttm180 -68.29 -62.27 1.47 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.688 179.987 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.8 t -53.7 -26.43 22.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.802 179.561 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.34 -46.87 91.34 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.933 179.596 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.452 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -66.93 -28.58 68.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.702 0.286 . . . . 0.0 110.976 179.516 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.58 -43.89 96.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.815 -179.701 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 3.8 ptp180 -83.05 -37.08 24.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.826 179.808 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.6 m -53.22 -41.31 65.22 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.099 179.887 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 73' ' ' ALA . 78.4 mt -55.4 -59.32 4.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.888 0.375 . . . . 0.0 110.138 179.049 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -51.88 -32.65 33.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.811 178.74 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 18.9 mt-30 -66.42 -31.09 71.64 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-O 120.945 0.402 . . . . 0.0 110.366 179.652 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.62 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 90.6 mt -75.91 -61.54 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.464 -179.721 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 57.81 110.63 0.01 OUTLIER Glycine 0 CA--C 1.52 0.389 0 C-N-CA 120.995 -0.622 . . . . 0.0 113.157 179.891 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 150.82 -165.65 30.2 Favored Glycine 0 C--N 1.33 0.25 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.723 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.577 ' HG3' HH21 ' A' ' 86' ' ' ARG . 1.9 mp0 -72.21 -40.59 67.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.94 0.4 . . . . 0.0 110.643 179.735 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.51 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -54.75 -50.98 67.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.476 179.681 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.51 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 9.9 p -70.85 -27.12 29.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.072 179.4 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.577 HH21 ' HG3' ' A' ' 83' ' ' GLU . 7.4 ttp180 -58.66 -30.49 67.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.933 -178.764 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.63 -23.37 27.55 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.79 0.292 . . . . 0.0 111.79 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.5 -37.68 71.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.44 -179.327 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.434 ' SD ' HD23 ' A' ' 108' ' ' LEU . 9.8 ptt? -72.0 -36.7 69.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.55 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -68.38 -45.27 73.18 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.502 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -60.82 -24.92 66.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.708 179.576 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.725 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -86.45 -33.84 20.28 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.403 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.68 -15.23 57.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.062 179.822 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -84.37 -30.3 25.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.94 179.522 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.5 p -119.82 21.56 11.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.394 179.415 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -50.72 127.0 26.71 Favored Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 114.923 -1.035 . . . . 0.0 113.612 -178.896 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 t -144.22 130.17 19.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.751 179.015 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 57.89 -152.31 28.06 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.758 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.468 ' HB3' HH12 ' A' ' 70' ' ' ARG . 49.9 t80 -52.77 -33.13 47.21 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.655 0.264 . . . . 0.0 111.348 -179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.604 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -52.3 -40.31 61.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.741 -179.571 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 -71.78 -52.84 15.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.604 -179.597 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.636 ' HE3' HD22 ' A' ' 106' ' ' ASN . 48.7 tptt -45.61 -26.48 0.61 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.244 0.545 . . . . 0.0 110.51 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 99' ' ' PHE . 45.6 t -66.93 -57.81 8.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.46 179.617 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.607 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -54.62 -62.17 1.83 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.943 0.719 . . . . 0.0 112.943 -179.135 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.451 HG13 ' N ' ' A' ' 106' ' ' ASN . 7.5 p -53.88 -47.1 64.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.721 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.636 HD22 ' HE3' ' A' ' 102' ' ' LYS . 7.0 m-20 -70.79 -35.55 72.61 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.271 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -64.9 -26.18 68.21 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 120.817 0.341 . . . . 0.0 111.385 -178.238 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.434 HD23 ' SD ' ' A' ' 89' ' ' MET . 39.7 mt -49.98 -26.65 4.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.295 179.715 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.53 -6.2 0.67 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.226 -179.399 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 p -114.8 -74.23 0.62 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 13.0 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.916 -179.834 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.6 tpt . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.809 0.338 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.06 141.49 45.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.096 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.7 t70 62.49 177.58 0.14 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.965 179.849 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 65.41 14.77 9.66 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.043 179.681 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.434 ' CG ' HG12 ' A' ' 8' ' ' VAL . 64.1 t30 -126.96 29.01 5.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.79 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -58.8 -46.71 86.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.008 0.432 . . . . 0.0 110.001 179.414 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -105.12 90.06 3.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.73 179.142 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.434 HG12 ' CG ' ' A' ' 5' ' ' ASN . 1.5 m -84.77 -28.3 6.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.836 -178.713 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.4 tpp180 -114.32 -54.93 2.55 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.003 -179.821 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.458 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 1.7 mpp_? -47.65 112.95 0.62 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 178.965 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.458 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 20.4 t70 75.76 90.73 0.08 Allowed 'General case' 0 C--O 1.231 0.131 0 O-C-N 123.656 0.597 . . . . 0.0 110.413 -178.896 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.75 HG22 ' H ' ' A' ' 13' ' ' SER . 3.5 p -171.42 -177.22 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.656 -179.526 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.75 ' H ' HG22 ' A' ' 12' ' ' VAL . 32.6 t 68.98 11.51 8.36 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.001 0.429 . . . . 0.0 111.139 179.53 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.9 t -170.82 -11.77 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.277 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.79 -0.06 57.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.072 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.612 HD12 ' H ' ' A' ' 16' ' ' LEU . 4.8 mp -44.06 -20.94 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.232 -179.291 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 38.7 t -48.32 -32.92 8.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.518 0.199 . . . . 0.0 111.357 179.921 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -178.21 90.46 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.861 -179.941 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.486 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 1.6 mmt -133.4 -44.33 0.84 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.663 -179.923 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 120.71 -116.58 3.24 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.346 -0.93 . . . . 0.0 113.34 179.864 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -90.2 -23.2 21.35 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.08 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.486 ' HG2' ' HB3' ' A' ' 19' ' ' MET . 10.9 pt-20 -66.97 -23.5 65.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.923 0.392 . . . . 0.0 110.385 179.963 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.471 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -103.65 6.92 37.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.709 179.522 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.506 ' CE2' ' HB3' ' A' ' 53' ' ' ARG . 1.1 t80 -59.15 -53.17 61.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.515 179.453 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.453 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 4.2 mm-40 -63.51 -57.13 21.21 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.629 179.106 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HB2' HD21 ' A' ' 16' ' ' LEU . 32.9 Cg_exo -50.06 -21.96 7.16 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 121.993 1.795 . . . . 0.0 110.892 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.671 HD21 HG13 ' A' ' 46' ' ' ILE . 1.3 tp -79.31 -42.89 24.71 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 114.632 -1.167 . . . . 0.0 109.87 179.717 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.621 HD12 HD12 ' A' ' 31' ' ' LEU . 18.5 tp -75.6 -21.06 58.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.108 178.844 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 15.4 mm-40 -76.45 -40.69 49.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.519 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.403 ' O ' ' HB3' ' A' ' 33' ' ' ASN . 72.6 p -66.24 -16.29 63.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.491 -179.83 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.621 HD12 HD12 ' A' ' 28' ' ' LEU . 78.2 mt -65.71 -8.71 22.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.727 0.298 . . . . 0.0 111.129 179.955 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.4 t -95.08 8.96 41.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.733 179.71 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.459 HD22 ' HB3' ' A' ' 35' ' ' ASP . 0.6 OUTLIER -81.08 128.84 34.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.169 -179.808 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.17 -27.11 65.37 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.276 -179.084 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.459 ' HB3' HD22 ' A' ' 33' ' ' ASN . 36.7 t70 -75.85 163.0 27.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.793 0.33 . . . . 0.0 111.075 -179.59 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 13.5 p90 -107.67 -31.89 7.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.29 -179.847 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -59.72 -39.03 83.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.0 mt -80.52 -44.75 21.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.828 179.841 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -65.12 -19.56 66.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.741 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.76 -66.44 2.63 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.531 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.1 -35.78 7.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.795 0.331 . . . . 0.0 111.206 179.755 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.2 -49.45 77.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.54 179.622 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.406 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -68.12 -34.55 76.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.783 179.452 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -67.23 -27.86 67.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.012 -179.234 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.6 mt -99.16 -28.79 3.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.78 0.324 . . . . 0.0 111.617 -179.256 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.671 HG13 HD21 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -60.86 -28.7 43.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.176 -179.32 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -69.4 -24.73 75.98 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.27 179.666 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -64.68 -32.97 74.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.775 0.321 . . . . 0.0 110.463 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.469 ' C ' ' H ' ' A' ' 51' ' ' ASP . 17.8 m-85 -92.32 108.7 20.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.441 179.581 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.0 mp0 -76.58 31.26 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.035 0.445 . . . . 0.0 111.005 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 49' ' ' PHE . 20.8 t70 -85.52 160.32 19.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.903 -179.931 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.98 -40.28 97.27 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.795 -179.316 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.506 ' HB3' ' CE2' ' A' ' 24' ' ' PHE . 39.6 ttm180 -65.33 -12.28 50.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.133 -179.839 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.52 ' O ' HD13 ' A' ' 58' ' ' LEU . . . -106.11 8.94 32.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.134 -179.143 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 51' ' ' ASP . 40.9 t -92.1 -41.73 13.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.213 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.515 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 5.8 tp10 -55.9 -49.17 94.49 Favored Pre-proline 0 C--N 1.331 -0.236 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.088 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.515 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 97.0 Cg_exo -44.24 -52.93 5.23 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.22 1.947 . . . . 0.0 112.055 -179.963 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 54' ' ' ALA . 6.8 mp -51.44 -40.32 59.15 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.888 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.9 mm -59.82 -60.83 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.983 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -70.06 -22.35 63.08 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -179.233 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.686 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -76.23 -44.92 35.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -177.966 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.71 ' HB3' HD11 ' A' ' 92' ' ' LEU . 31.3 mt -62.21 -9.2 7.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.117 0.484 . . . . 0.0 110.698 -179.032 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -127.38 -2.54 6.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.652 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.483 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 47.7 t0 -61.36 -33.89 74.39 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.338 -179.766 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.659 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 3.7 m-20 59.79 25.68 14.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.796 -179.548 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.533 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.9 m -86.29 8.65 20.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.42 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 74.31 -94.31 0.82 Allowed Glycine 0 C--N 1.333 0.361 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.701 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.66 -42.19 78.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.975 0.417 . . . . 0.0 110.502 179.892 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.686 HG12 ' HG ' ' A' ' 61' ' ' LEU . 25.7 t -71.66 -33.19 48.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.726 -179.666 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.659 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 47.6 ttt180 -73.26 -61.23 1.89 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.01 -179.934 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.2 m -51.65 -30.17 20.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.993 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.51 -43.7 95.84 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.35 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.533 ' HA ' ' HB2' ' A' ' 76' ' ' SER . . . -72.35 -34.04 67.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.795 0.331 . . . . 0.0 110.832 179.718 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.515 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -53.65 -44.11 69.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.567 179.759 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.4 ptp85 -83.02 -28.2 29.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.367 179.348 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.533 ' HB2' ' HA ' ' A' ' 73' ' ' ALA . 58.7 m -62.29 -20.98 64.86 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.189 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.567 HD21 HD11 ' A' ' 62' ' ' LEU . 4.9 mt -66.34 -61.26 2.1 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.734 0.302 . . . . 0.0 110.437 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -61.45 -22.28 64.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.761 178.685 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.511 ' HB2' ' HA ' ' A' ' 76' ' ' SER . 0.0 OUTLIER -65.74 -37.85 87.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.165 179.307 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.506 ' HB ' HG21 ' A' ' 85' ' ' VAL . 77.6 mt -87.61 -60.89 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.085 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.66 125.59 0.02 OUTLIER Glycine 0 C--N 1.331 0.258 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.847 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 147.08 -174.13 26.99 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.992 179.743 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -72.21 -22.11 61.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.939 0.4 . . . . 0.0 111.097 -179.889 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.587 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -71.18 -46.75 60.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.872 -179.935 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.55 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 12.1 t -70.73 -26.64 28.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.447 179.898 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ppt_? -58.69 -20.03 44.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.445 -179.528 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -82.29 -30.56 30.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.595 179.457 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.25 -40.32 74.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.194 179.801 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.502 ' O ' ' HB1' ' A' ' 104' ' ' ALA . 16.1 ptt? -71.18 -39.18 72.0 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.723 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -64.73 -26.65 68.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.988 0.423 . . . . 0.0 109.899 179.028 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -64.72 -48.01 76.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.23 179.325 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.71 HD11 ' HB3' ' A' ' 62' ' ' LEU . 54.5 mt -68.49 -35.07 77.0 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.403 179.39 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.477 ' HA ' ' CZ ' ' A' ' 101' ' ' ARG . . . -55.18 -33.56 63.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.834 179.058 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -96.99 -11.92 23.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.155 179.681 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.1 m -92.24 -28.62 16.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.951 0.405 . . . . 0.0 111.065 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 62.7 113.3 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.62 -179.642 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.619 ' H ' ' HB2' ' A' ' 101' ' ' ARG . 14.1 p -146.56 -176.58 5.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.734 0.302 . . . . 0.0 111.032 -179.533 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -83.69 -83.71 0.92 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.512 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.442 ' O ' HG23 ' A' ' 103' ' ' VAL . 58.2 t80 -78.52 -40.35 35.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.746 0.307 . . . . 0.0 111.01 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.414 ' HB3' ' OG1' ' A' ' 97' ' ' THR . . . -57.01 -43.32 81.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.651 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.619 ' HB2' ' H ' ' A' ' 97' ' ' THR . 23.8 tpt85 -59.9 -61.39 2.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.497 -179.384 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 54.2 tttt -50.13 -37.37 33.92 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.174 0.511 . . . . 0.0 110.118 179.63 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.515 HG21 ' HB1' ' A' ' 74' ' ' ALA . 11.9 t -61.5 -41.86 91.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.902 179.369 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.502 ' HB1' ' O ' ' A' ' 89' ' ' MET . . . -64.88 -59.75 3.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.139 -179.473 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.451 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 4.4 p -58.96 -47.16 90.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.819 -178.969 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.437 ' N ' HG13 ' A' ' 105' ' ' VAL . 37.0 t30 -64.67 -32.57 74.29 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.559 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -62.45 -26.92 68.77 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 120.666 0.27 . . . . 0.0 111.143 -178.976 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -51.94 -26.2 9.9 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.25 179.766 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -55.35 -18.37 6.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.284 179.887 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.0 m -101.99 -74.72 0.62 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.936 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 44.2 m80 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.69 179.576 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.768 0.318 . . . . 0.0 110.674 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.28 -58.76 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.045 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -140.01 -2.12 1.52 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.641 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -81.91 -62.1 1.73 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.738 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 48.8 m-20 -99.71 31.4 3.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.552 179.674 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 54.2 tttm -91.93 -24.01 19.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.226 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 34.3 p-90 -147.04 25.55 1.13 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.413 -179.748 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.404 ' HA ' ' OE2' ' A' ' 22' ' ' GLU . 2.5 p -58.41 96.04 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.142 0.496 . . . . 0.0 111.123 179.942 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.46 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 21.5 ttm180 59.94 9.04 1.59 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.312 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 31.0 mmm180 -67.11 104.43 1.42 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.951 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 9.3 m-20 69.09 12.19 8.48 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.573 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.613 HG12 ' H ' ' A' ' 14' ' ' THR . 38.3 t -89.82 -88.64 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.648 0.261 . . . . 0.0 111.164 -179.883 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.8 t 55.87 18.83 3.19 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.697 179.733 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.613 ' H ' HG12 ' A' ' 12' ' ' VAL . 9.1 t -141.33 11.54 2.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.02 0.438 . . . . 0.0 111.043 179.87 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.54 ' O ' ' HG3' ' A' ' 19' ' ' MET . . . -83.2 -0.06 47.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.468 -179.781 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -44.01 -17.71 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -178.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.425 ' N ' ' O ' ' A' ' 15' ' ' ALA . 88.2 p -60.85 -46.97 88.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.703 0.287 . . . . 0.0 110.504 178.959 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -175.97 102.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.812 179.811 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.54 ' HG3' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -133.08 -43.57 0.87 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.659 -179.577 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.94 6.35 89.51 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.626 -0.797 . . . . 0.0 113.012 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -175.88 -28.64 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.565 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.509 ' H ' ' HB2' ' A' ' 19' ' ' MET . 5.2 mm-40 -73.5 -43.45 60.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.369 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.432 ' HB3' ' SD ' ' A' ' 19' ' ' MET . . . -105.86 17.13 24.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -178.369 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.462 ' CE1' ' HB3' ' A' ' 53' ' ' ARG . 2.1 t80 -57.96 -51.34 70.06 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.3 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.457 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -63.37 -57.8 18.56 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.231 179.508 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HD3' ' HB2' ' A' ' 25' ' ' GLU . 83.3 Cg_exo -46.57 -25.2 3.3 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 122.065 1.843 . . . . 0.0 111.467 -179.706 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 19.7 mt -77.5 -46.54 22.12 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.894 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.625 HD12 HD12 ' A' ' 31' ' ' LEU . 27.3 tp -68.47 -19.8 64.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.918 178.855 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.58 -23.82 53.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.469 179.824 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.5 m -66.39 -24.08 66.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.132 -179.675 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.625 HD12 HD12 ' A' ' 28' ' ' LEU . 85.3 mt -65.34 -10.77 35.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.842 0.353 . . . . 0.0 110.643 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.6 t -88.67 8.37 28.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.534 179.851 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -102.32 130.04 48.94 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.33 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -68.27 -4.03 12.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.966 179.366 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -77.6 150.54 34.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.734 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 46.9 m0 -88.04 -46.25 9.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.965 -179.973 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -60.29 -37.22 79.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.238 -179.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.9 mt -75.03 -57.28 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.244 -179.781 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.564 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 24.7 ttm180 -59.03 -23.22 61.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.066 -179.857 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.402 ' HA2' ' HA ' ' A' ' 69' ' ' VAL . . . -77.06 -59.07 3.24 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.767 -179.741 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.69 8.37 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.763 0.316 . . . . 0.0 111.502 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.82 -56.53 20.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.769 179.741 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.454 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -65.79 -35.37 80.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.833 179.359 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -55.37 -33.37 63.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.673 -179.582 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 46.7 mm -99.5 -23.04 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.244 0.545 . . . . 0.0 110.758 -179.835 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.623 HG23 ' HB1' ' A' ' 54' ' ' ALA . 1.0 OUTLIER -60.04 -32.53 50.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.767 -179.209 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.59 -22.2 77.87 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.608 -0.806 . . . . 0.0 113.092 -179.31 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -70.74 -8.12 49.87 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.19 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -94.97 -26.81 15.95 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.566 ' HG3' HD12 ' A' ' 80' ' ' ILE . 19.2 mp0 57.76 30.52 19.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.995 0.426 . . . . 0.0 111.005 -179.577 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.412 ' O ' HG23 ' A' ' 55' ' ' VAL . 23.6 t70 -102.43 161.02 14.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.995 -179.822 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -62.44 -37.98 88.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.066 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.462 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 17.9 ttm180 -67.09 -9.0 34.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.586 179.741 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.623 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -103.74 -9.63 18.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.86 -179.26 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 51' ' ' ASP . 68.1 t -82.91 -35.16 12.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.245 -179.827 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.607 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 26.9 tt0 -60.27 -51.37 80.72 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.778 -179.454 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.607 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 54.1 Cg_exo -52.5 -34.86 64.03 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.148 1.898 . . . . 0.0 112.595 179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.537 ' HA ' ' HB2' ' A' ' 73' ' ' ALA . 8.7 mt -72.18 -27.27 62.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.202 -179.339 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 33.3 mm -63.05 -59.75 3.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.315 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -70.03 -7.02 37.63 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -178.342 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.764 ' HG ' HG12 ' A' ' 69' ' ' VAL . 3.1 mp -89.84 -40.57 12.35 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -177.997 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.833 HD11 HD11 ' A' ' 77' ' ' LEU . 4.3 mt -59.68 -14.81 15.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.278 0.561 . . . . 0.0 110.244 -178.888 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -104.46 -27.93 11.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.441 179.136 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.46 ' O ' ' HB2' ' A' ' 70' ' ' ARG . 34.2 t70 -59.77 138.31 57.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.853 -179.765 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -110.74 39.04 2.32 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.043 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 67.2 m -86.49 -30.68 21.79 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.283 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 115.54 -92.06 0.57 Allowed Glycine 0 C--N 1.329 0.175 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.032 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -57.96 -31.55 66.99 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.191 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.764 HG12 ' HG ' ' A' ' 61' ' ' LEU . 22.7 t -69.16 -51.2 45.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.05 179.829 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 57.9 ttp180 -61.02 -58.59 7.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.641 -179.816 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 63.9 m -51.05 -27.09 7.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.867 -179.043 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.61 -56.04 26.73 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.292 179.902 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.537 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . . . -60.2 -38.66 83.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.909 0.336 . . . . 0.0 111.909 179.767 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.05 -44.42 67.42 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -178.71 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.46 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 7.7 ptp180 -84.57 -35.42 22.81 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.269 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.523 ' HA ' HE21 ' A' ' 79' ' ' GLN . 67.4 m -63.39 -36.05 82.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.048 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.833 HD11 HD11 ' A' ' 62' ' ' LEU . 34.5 mt -61.76 -61.07 2.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.571 0.224 . . . . 0.0 111.221 -179.902 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.434 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 38.1 tt0 -62.25 -19.9 63.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.049 0.452 . . . . 0.0 110.395 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.523 HE21 ' HA ' ' A' ' 76' ' ' SER . 8.2 tt0 -62.83 -25.22 68.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.498 179.668 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.566 HD12 ' HG3' ' A' ' 50' ' ' GLN . 2.5 mm -90.79 -60.14 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.056 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.03 98.27 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.775 -0.648 . . . . 0.0 112.46 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 169.35 -174.15 43.73 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.46 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -70.93 -23.85 62.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.736 0.303 . . . . 0.0 110.673 -179.856 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.504 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -62.7 -53.16 58.72 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.646 179.866 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.697 HG13 HD22 ' A' ' 77' ' ' LEU . 93.6 t -70.65 -24.69 25.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.943 0.401 . . . . 0.0 110.692 179.217 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.3 -27.48 35.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.615 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.86 -30.21 23.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.442 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.13 -38.85 72.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.242 179.894 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.818 ' HE2' HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -68.64 -32.84 72.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.671 179.434 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -64.9 -42.51 94.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.316 179.3 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -58.73 -38.17 77.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.084 179.793 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.644 HD22 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -86.54 -23.11 25.97 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.462 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.27 -21.32 62.11 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.528 179.641 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.47 -26.03 38.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.684 179.591 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 82.4 p -119.59 22.93 11.44 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.248 178.775 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -54.38 123.3 27.48 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.009 -0.996 . . . . 0.0 113.594 -178.781 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.0 t -145.95 130.04 17.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.46 -0.37 . . . . 0.0 110.684 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.09 -139.07 47.99 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.066 -0.588 . . . . 0.0 112.879 -179.76 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -60.8 -31.55 70.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.811 0.338 . . . . 0.0 111.088 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.578 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -54.1 -42.52 69.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.913 -179.404 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -67.11 -58.49 4.78 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -178.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.0 ttmp? -45.52 -30.04 1.33 Allowed 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.046 0.451 . . . . 0.0 110.885 -179.497 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.477 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 12.2 t -60.24 -57.08 13.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.236 179.511 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.624 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -63.74 -53.59 48.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.283 -179.194 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.8 t -61.28 -62.01 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -178.195 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -55.61 -29.4 59.08 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -178.124 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.434 ' CE1' ' HA ' ' A' ' 78' ' ' GLU . 3.0 t80 -58.84 -32.96 69.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.927 0.394 . . . . 0.0 110.635 -179.479 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.818 HD11 ' HE2' ' A' ' 89' ' ' MET . 37.6 mt -55.28 -23.44 23.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.606 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.98 6.66 8.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.599 -179.826 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.7 m -126.44 -74.93 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.428 -179.863 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.579 -179.959 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ppp? . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.723 0.297 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.32 131.82 51.97 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.029 -179.978 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 57.87 -90.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.897 -179.562 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -172.57 55.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.91 0.386 . . . . 0.0 110.956 179.803 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 57.27 20.89 6.14 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.391 179.555 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' HB3' HH11 ' A' ' 10' ' ' ARG . 67.6 mttm -89.92 43.98 1.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.087 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 53.5 p-90 -148.15 20.9 1.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.393 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.9 p -90.88 85.03 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.293 0.568 . . . . 0.0 111.184 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.439 ' N ' ' HB3' ' A' ' 22' ' ' GLU . 53.9 ttp180 68.89 6.08 5.38 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.525 179.5 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 48.3 ttt180 -79.27 107.12 11.8 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.241 178.477 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.457 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 21.5 t70 73.59 -3.95 2.35 Favored 'General case' 0 N--CA 1.463 0.183 0 O-C-N 123.543 0.527 . . . . 0.0 111.035 -179.531 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.877 HG13 ' HB3' ' A' ' 15' ' ' ALA . 76.4 t -59.24 -85.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.274 -179.633 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.405 ' N ' HG12 ' A' ' 12' ' ' VAL . 46.7 t 55.37 -88.25 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.675 0.274 . . . . 0.0 111.475 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.3 p -95.73 14.02 24.55 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.39 -179.736 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.877 ' HB3' HG13 ' A' ' 12' ' ' VAL . . . -72.51 -1.69 16.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.89 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 pp -50.75 -12.65 0.11 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.749 179.632 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.7 t -45.52 -23.59 0.24 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.268 0.469 . . . . 0.0 112.268 -179.691 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 55.9 ttp180 -162.74 -61.54 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 179.991 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 21.3 ptm -48.83 -43.19 38.3 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.968 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 51.47 -154.26 4.47 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.747 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.511 ' H ' ' HE2' ' A' ' 49' ' ' PHE . 11.2 m-20 64.31 -73.78 0.05 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.95 0.405 . . . . 0.0 110.73 -179.54 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' HB2' HG11 ' A' ' 12' ' ' VAL . 4.3 mm-40 -63.48 -18.14 63.47 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.214 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.43 5.9 32.05 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.378 -179.889 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.555 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 4.7 t80 -53.91 -53.8 47.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.692 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -63.55 -56.06 29.51 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.362 179.0 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.497 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 83.7 Cg_exo -45.34 -27.52 3.2 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.118 1.879 . . . . 0.0 111.821 179.593 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.596 HD13 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -64.89 -59.14 4.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.756 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 25' ' ' GLU . 4.2 pp -68.53 -19.23 64.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.109 0.48 . . . . 0.0 110.161 178.993 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.455 ' N ' HD12 ' A' ' 28' ' ' LEU . 40.3 tt0 -69.65 -34.69 74.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.453 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.7 t -66.42 -14.99 62.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.383 -179.827 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.538 HD11 ' HG3' ' A' ' 57' ' ' PRO . 95.9 mt -65.65 -10.26 34.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.804 0.335 . . . . 0.0 110.801 179.858 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.3 m -113.61 12.61 18.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.065 -179.936 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -78.68 143.05 36.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.847 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -67.79 -25.41 65.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.06 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -87.56 135.06 33.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.953 -179.965 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 27.9 p-90 -82.24 -35.22 28.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.991 -179.897 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.451 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 40.7 ttp180 -58.73 -30.7 67.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.151 179.785 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.0 mm -82.79 -41.19 17.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.353 179.884 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.459 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 39.6 ttm180 -63.63 -40.14 96.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.553 -179.362 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.527 ' HA2' HG13 ' A' ' 69' ' ' VAL . . . -59.09 -60.55 8.67 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.3 -179.892 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.12 -27.79 2.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.638 0.256 . . . . 0.0 111.317 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 39' ' ' ARG . . . -58.94 -56.33 23.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.839 179.611 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.511 ' HB1' HD23 ' A' ' 58' ' ' LEU . . . -68.94 -25.33 64.5 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.758 0.313 . . . . 0.0 111.215 179.946 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.6 m95 -55.44 -44.96 76.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.054 -179.453 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.9 mm -99.95 -21.07 5.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.022 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.634 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.9 tt -58.21 -30.77 40.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.765 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.494 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -65.39 -16.72 63.2 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.955 -179.399 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.421 ' CG ' HE22 ' A' ' 79' ' ' GLN . 2.1 m-20 -70.81 -25.04 62.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.641 0.258 . . . . 0.0 111.617 -179.573 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.511 ' HE2' ' H ' ' A' ' 21' ' ' ASP . 42.4 m-85 -72.18 -23.63 61.3 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.721 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 56.84 26.21 11.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.932 0.396 . . . . 0.0 111.425 179.83 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -101.99 160.54 14.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.218 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.533 ' O ' HG22 ' A' ' 55' ' ' VAL . 9.8 pt-20 -65.58 -34.14 77.54 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.247 0.546 . . . . 0.0 110.62 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 18.7 ttm180 -69.36 -10.24 57.01 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.415 179.204 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.418 ' C ' ' HD2' ' A' ' 57' ' ' PRO . . . -104.11 -21.07 13.63 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.795 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.533 HG22 ' O ' ' A' ' 52' ' ' GLU . 19.4 m -76.61 -35.99 26.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.113 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.588 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 31.7 tt0 -57.8 -51.88 78.5 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 111.49 0.181 . . . . 0.0 111.49 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.634 ' HG2' HD13 ' A' ' 46' ' ' ILE . 66.6 Cg_exo -52.03 -23.43 16.99 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.131 1.888 . . . . 0.0 112.151 179.399 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.554 HD22 ' HA ' ' A' ' 73' ' ' ALA . 50.6 mt -80.02 -35.97 36.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.496 179.713 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.24 -54.27 37.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.028 -179.588 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -70.12 -14.43 62.65 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -178.366 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.734 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 tp -90.05 -27.45 19.7 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.442 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.632 HD11 HD11 ' A' ' 77' ' ' LEU . 10.1 mt -65.81 -9.77 31.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.139 0.495 . . . . 0.0 110.475 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -121.7 1.8 10.01 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.071 -179.683 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -61.01 -32.15 71.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.19 0.519 . . . . 0.0 111.289 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 52.47 28.65 6.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.333 -0.849 . . . . 0.0 112.02 179.833 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.498 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 7.4 t -85.33 -25.45 27.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.983 0.421 . . . . 0.0 110.818 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.65 -108.83 0.99 Allowed Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.966 -179.832 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.451 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.9 OUTLIER -59.7 -27.46 66.45 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.974 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.734 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.8 t -66.99 -34.54 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.932 178.968 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -75.73 -49.33 18.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.994 179.16 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 56.7 m -67.1 -21.37 65.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.996 179.414 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -62.74 -63.39 4.67 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.301 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.554 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -55.23 -25.77 35.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.879 0.371 . . . . 0.0 111.124 179.348 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.49 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.78 -58.28 8.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.55 -179.63 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -64.6 -37.59 88.1 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.324 -179.729 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.494 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 38.6 m -55.79 -38.38 69.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.208 -179.694 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.632 HD11 HD11 ' A' ' 62' ' ' LEU . 15.8 mt -69.73 -60.02 2.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.666 179.303 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.433 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 29.9 mt-10 -51.7 -25.93 8.29 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.245 0.545 . . . . 0.0 109.927 178.436 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' A' ' 76' ' ' SER . 47.6 tt0 -70.11 -44.09 69.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.904 179.164 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.447 ' HB ' HG11 ' A' ' 85' ' ' VAL . 79.9 mt -57.59 -58.43 6.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.201 178.901 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.495 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 70.29 135.41 0.1 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.915 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 124.73 174.81 14.11 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.828 179.685 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -61.79 -22.91 65.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.989 0.423 . . . . 0.0 110.551 179.562 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.563 ' H ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -55.13 -63.21 1.23 Allowed 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.829 -179.896 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.447 HG11 ' HB ' ' A' ' 80' ' ' ILE . 5.2 m -70.28 -24.55 25.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.815 179.819 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -55.86 -28.71 57.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.498 -178.566 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.19 -26.44 26.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.861 0.363 . . . . 0.0 110.706 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.48 -46.18 60.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.087 179.918 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.58 ' N ' ' HE2' ' A' ' 89' ' ' MET . 0.0 OUTLIER -72.11 -37.45 69.52 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 179.828 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -55.56 -37.15 67.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.95 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -81.52 -20.96 38.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.901 179.328 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.555 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -83.21 -26.13 31.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.663 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.66 -24.85 67.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.728 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -80.04 -22.7 42.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.293 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 30.2 p -120.39 15.93 12.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.173 179.227 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -56.33 127.55 43.92 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 114.794 -1.093 . . . . 0.0 113.468 -178.936 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.0 t -139.78 130.3 25.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.963 0.411 . . . . 0.0 110.55 178.991 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.6 -132.03 51.29 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.705 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -69.49 -33.92 73.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.635 0.255 . . . . 0.0 111.589 -179.716 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.473 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -49.79 -33.01 15.28 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.008 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.404 ' C ' ' N ' ' A' ' 103' ' ' VAL . 49.9 ttp180 -79.76 -52.52 7.82 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -178.823 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -45.91 -23.24 0.27 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.263 0.554 . . . . 0.0 110.429 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.49 HG21 ' HB1' ' A' ' 74' ' ' ALA . 55.6 t -71.47 -60.24 2.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.341 179.664 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.542 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -54.06 -49.95 67.85 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.208 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.0 t -64.87 -63.23 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.215 -0.902 . . . . 0.0 113.008 -177.615 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -55.39 -46.29 76.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.626 -178.379 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.495 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 39.2 t80 -60.0 -37.54 80.02 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.196 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.579 ' O ' HD12 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -49.82 -25.31 2.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.373 -178.116 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.2 6.27 1.02 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.683 -179.767 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 76.8 p -96.4 -71.24 0.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.595 0.236 . . . . 0.0 111.445 -179.887 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 62.4 t-80 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.805 179.964 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.73 0.3 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.77 160.16 19.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.967 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 61.23 170.64 0.1 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.152 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 57.49 18.3 4.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.903 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -127.02 -30.12 2.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.734 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -67.24 -17.01 64.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.91 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 36.6 m95 -114.2 37.71 3.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.002 -179.787 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.1 p -70.54 143.86 14.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.177 179.999 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.567 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 59.7 ttt180 70.88 8.25 6.48 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.719 179.607 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.486 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 70.1 ttt180 -61.63 105.06 0.49 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.382 178.731 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.486 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 3.8 m-20 70.55 2.13 3.96 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.892 -179.226 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.567 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 4.6 t -94.49 166.94 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.846 179.953 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.489 ' H ' HG12 ' A' ' 12' ' ' VAL . 36.5 t -156.9 -39.38 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.944 179.815 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.509 HG21 ' HB3' ' A' ' 17' ' ' SER . 9.7 t -70.22 160.45 32.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.584 179.685 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -96.03 -70.18 0.72 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -179.12 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.695 HD12 ' N ' ' A' ' 17' ' ' SER . 1.3 pp -86.41 -30.75 21.86 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.385 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.695 ' N ' HD12 ' A' ' 16' ' ' LEU . 32.3 t -54.99 -44.52 74.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.649 0.261 . . . . 0.0 111.018 -179.404 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 21.7 ttp180 -168.07 110.12 0.59 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.118 179.617 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.421 ' HB2' ' HB3' ' A' ' 23' ' ' ALA . 1.0 OUTLIER -133.06 -39.5 0.94 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.471 179.525 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 102.94 -88.37 0.65 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.773 179.576 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -125.04 13.06 8.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.611 0.243 . . . . 0.0 111.154 -179.56 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -100.08 -45.03 5.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.862 -179.79 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.593 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -106.72 13.13 28.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.631 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.531 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -61.04 -51.12 70.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.984 0.421 . . . . 0.0 110.584 179.904 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -62.94 -52.99 59.5 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.1 179.806 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.593 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 74.3 Cg_exo -40.61 -28.93 0.36 Allowed 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 122.257 1.972 . . . . 0.0 111.722 179.285 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 49.2 mt -72.64 -55.04 7.46 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.101 178.714 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.698 HD12 HD12 ' A' ' 31' ' ' LEU . 23.8 tp -63.09 -22.9 67.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.167 179.021 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -83.18 -34.17 26.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.996 179.763 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.3 t -66.23 -16.18 63.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.901 179.772 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.698 HD12 HD12 ' A' ' 28' ' ' LEU . 80.3 mt -63.4 -13.22 37.42 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.877 -179.999 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 90.3 p -100.64 22.34 12.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.773 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.01 146.18 27.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.963 -179.827 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -66.44 -20.9 66.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.385 -179.784 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -83.87 162.8 20.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.379 . . . . 0.0 111.176 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 14.5 p90 -103.11 -40.34 6.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.175 -179.997 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -61.72 -30.34 70.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.137 -179.924 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 31.8 mm -78.51 -42.05 25.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.452 -179.431 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.445 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 41.6 ttm180 -62.96 -44.7 95.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.302 -179.632 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.24 -57.92 12.05 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.892 -179.679 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.89 -28.9 4.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.718 0.294 . . . . 0.0 111.582 -179.811 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.439 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -63.7 -50.56 68.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.951 179.862 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.57 ' CB ' HD22 ' A' ' 61' ' ' LEU . . . -74.82 -25.23 58.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.432 -179.893 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -60.63 -37.98 83.25 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.408 -179.878 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.2 mm -99.53 -19.77 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.799 -179.397 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.469 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.3 tt -59.81 -36.79 68.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -178.417 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.445 ' HA2' HD11 ' A' ' 80' ' ' ILE . . . -70.97 -7.44 62.27 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.465 -0.874 . . . . 0.0 113.39 -179.099 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -70.78 -26.45 63.34 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -179.241 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -87.03 -27.03 23.44 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.813 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.571 ' HG3' HD13 ' A' ' 80' ' ' ILE . 19.0 mp0 60.74 60.94 1.78 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.76 0.314 . . . . 0.0 111.524 -179.607 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -127.99 176.95 7.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.787 179.47 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -64.22 -34.23 77.61 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.931 179.777 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.523 ' HA ' ' HE ' ' A' ' 53' ' ' ARG . 1.8 mmp_? -68.56 -11.44 59.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.252 -179.899 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.39 10.38 33.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.956 -179.342 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.5 t -91.54 -58.49 3.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.056 -179.275 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.434 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 39.4 tt0 -60.5 -46.28 97.37 Favored Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.094 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.543 ' HG3' HD13 ' A' ' 28' ' ' LEU . 95.2 Cg_exo -43.67 -48.08 9.07 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.191 1.927 . . . . 0.0 112.647 -179.898 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.486 HD22 ' HA ' ' A' ' 73' ' ' ALA . 10.3 mt -59.74 -36.51 76.76 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.276 -179.477 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.695 HD11 ' HB1' ' A' ' 88' ' ' ALA . 40.2 mm -61.39 -61.15 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.181 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.527 ' HD2' HD13 ' A' ' 31' ' ' LEU . 5.9 ptpt -70.25 -11.91 61.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.978 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.656 HD23 ' H ' ' A' ' 73' ' ' ALA . 1.3 tp -89.97 -45.75 8.98 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -177.821 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.491 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 3.9 pp -67.26 -8.38 31.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 111.291 -178.438 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -101.71 -4.32 26.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.189 -179.877 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.436 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 2.1 m-20 -61.3 -33.85 74.25 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.61 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.616 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 38.4 m-20 59.6 27.58 16.82 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.183 -179.35 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.491 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 11.7 m -82.12 -31.83 30.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.59 -179.335 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 135.78 -109.36 0.74 Allowed Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.792 -179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -58.14 -28.71 64.95 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.757 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.491 ' HB ' ' HB2' ' A' ' 66' ' ' SER . 49.4 t -65.5 -45.9 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.477 178.688 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.616 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 53.0 ttp180 -62.0 -48.88 78.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.389 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.9 m -67.12 -24.8 65.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.205 -179.993 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -55.37 -69.78 1.16 Allowed Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.386 -179.903 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.656 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -47.56 -31.98 4.94 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 179.295 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.86 -47.64 84.1 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.26 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -71.29 -40.3 70.95 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.157 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.537 ' O ' HG12 ' A' ' 80' ' ' ILE . 6.7 p -54.46 -27.85 40.37 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.692 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.659 ' HB3' HG11 ' A' ' 85' ' ' VAL . 17.6 mt -55.12 -60.69 3.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.743 0.306 . . . . 0.0 110.696 179.944 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 34.2 mt-10 -48.88 -36.9 18.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.989 178.262 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.446 ' OE1' ' HA ' ' A' ' 76' ' ' SER . 96.2 mt-30 -67.3 -30.4 70.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.855 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.571 HD13 ' HG3' ' A' ' 50' ' ' GLN . 50.6 mm -80.1 -60.48 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.337 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.597 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . 150.45 142.89 3.63 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.479 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 86' ' ' ARG . . . -69.27 -50.03 35.66 Favored Glycine 0 C--O 1.223 -0.569 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.16 -179.475 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -55.27 -35.94 65.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.586 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.597 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.0 OUTLIER -86.2 -58.59 2.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.005 0.431 . . . . 0.0 111.484 -179.046 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.659 HG11 ' HB3' ' A' ' 77' ' ' LEU . 75.7 t -60.09 -21.75 22.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.734 -179.489 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 12.1 ttp180 -52.95 -31.17 38.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.926 0.393 . . . . 0.0 110.608 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.05 -33.29 70.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.775 179.219 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.695 ' HB1' HD11 ' A' ' 59' ' ' ILE . . . -71.58 -46.27 59.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.441 179.444 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.621 ' HE3' HD23 ' A' ' 92' ' ' LEU . 24.8 mmm -63.08 -48.95 76.42 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.819 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -51.27 -33.27 27.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.617 178.829 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 60.7 tptt -79.03 -26.41 43.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.0 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.625 HD21 ' O ' ' A' ' 100' ' ' ALA . 2.0 tp -82.29 -25.55 33.89 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.566 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.93 -22.5 65.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.269 0.557 . . . . 0.0 109.604 178.897 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -80.25 -29.75 38.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.556 179.041 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 15.5 p -108.61 19.05 20.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.673 178.97 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.508 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -51.51 114.14 2.82 Favored Glycine 0 N--CA 1.447 -0.597 0 CA-C-N 115.237 -0.892 . . . . 0.0 113.235 -179.117 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.0 t -139.8 130.1 25.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.857 0.36 . . . . 0.0 110.799 179.348 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.29 -127.85 44.59 Favored Glycine 0 CA--C 1.519 0.326 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.862 179.929 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.485 ' O ' HG23 ' A' ' 103' ' ' VAL . 24.6 t80 -74.04 -31.52 62.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.71 0.29 . . . . 0.0 111.278 -179.808 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.625 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.66 -37.05 48.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.032 -179.248 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.508 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 29.6 ttt180 -67.37 -58.61 4.46 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.371 -179.535 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -47.03 -24.77 0.68 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.788 -179.973 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 55.6 t -66.01 -60.67 2.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.506 179.846 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.584 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -59.26 -39.66 83.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.901 -179.559 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 38.5 t -64.94 -58.22 8.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.69 -0.687 . . . . 0.0 112.445 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -68.76 -43.33 76.01 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -178.03 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.553 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 62.6 t80 -60.83 -45.6 93.83 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -178.41 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.504 ' HB3' ' O ' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -50.13 -19.66 0.81 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.709 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -71.27 6.58 1.64 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.765 179.423 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 26.5 p -92.91 -40.46 10.59 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.017 0.436 . . . . 0.0 110.109 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.985 179.333 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.3 mtp . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.95 0.405 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.34 -2.21 1.0 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.938 179.935 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -155.9 -17.31 0.1 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.822 179.99 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -99.46 -55.23 2.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.128 -179.758 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -130.34 130.56 44.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.918 -179.699 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -137.82 -22.45 1.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.144 179.946 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 17.1 p-90 -128.0 22.37 6.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.959 -179.964 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 21.7 t -106.27 -50.35 8.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.012 -179.97 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.436 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 99.5 mtt180 -122.81 27.68 7.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.103 -179.788 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -58.77 103.2 0.15 Allowed 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.033 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.9 t70 65.16 -1.28 0.92 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.354 -179.968 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.436 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 25.8 t -81.95 -96.99 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.31 -179.422 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.4 m 48.92 27.45 1.63 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-O 120.741 0.305 . . . . 0.0 111.332 -179.862 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.569 HG23 ' HA ' ' A' ' 18' ' ' ARG . 98.2 m -149.21 97.88 2.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.69 -179.736 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.65 ' N ' ' H ' ' A' ' 20' ' ' GLY . . . -96.06 -73.75 0.58 Allowed 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.805 179.383 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.428 HD13 ' C ' ' A' ' 16' ' ' LEU . 3.1 tm? -91.42 -68.95 0.76 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.142 0.496 . . . . 0.0 109.812 177.963 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 37.1 t -92.27 -52.79 4.51 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.857 177.983 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.569 ' HA ' HG23 ' A' ' 14' ' ' THR . 70.2 ttt180 175.0 73.5 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.098 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.563 ' H ' ' H ' ' A' ' 15' ' ' ALA . 24.9 mtt -133.25 -44.44 0.85 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.796 0.331 . . . . 0.0 111.383 -179.587 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.65 ' H ' ' N ' ' A' ' 15' ' ' ALA . . . 73.14 114.16 0.07 OUTLIER Glycine 0 CA--C 1.519 0.324 0 C-N-CA 121.1 -0.571 . . . . 0.0 113.231 179.537 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 58.3 9.3 0.99 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 179.492 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -106.94 -34.26 7.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.991 0.424 . . . . 0.0 110.043 179.524 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.26 18.72 21.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.992 179.761 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.8 t80 -55.33 -53.19 59.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.333 179.5 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.39 -57.05 21.94 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.573 178.996 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.515 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 96.4 Cg_exo -41.74 -33.2 1.84 Allowed 'Trans proline' 0 C--N 1.359 1.109 0 C-N-CA 122.321 2.014 . . . . 0.0 111.607 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 22.8 mt -61.93 -58.25 8.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.927 178.706 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.735 HD12 HD12 ' A' ' 31' ' ' LEU . 11.0 tp -64.75 -21.15 66.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.911 178.693 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -74.38 -33.16 62.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.258 179.828 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.1 m -66.44 -17.34 64.73 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.753 -179.753 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.735 HD12 HD12 ' A' ' 28' ' ' LEU . 81.8 mt -65.49 -6.75 11.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.838 0.352 . . . . 0.0 110.804 179.852 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 53.1 m -121.62 17.07 11.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.356 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.483 HD21 ' HB3' ' A' ' 35' ' ' ASP . 11.4 t30 -88.04 137.19 32.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.858 -179.785 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -53.28 -37.48 62.23 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.584 -179.575 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.483 ' HB3' HD21 ' A' ' 33' ' ' ASN . 16.9 t70 -76.09 133.65 40.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.705 -179.672 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -92.03 -27.27 17.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.363 -179.559 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 -60.61 -36.17 77.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.139 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.8 mt -81.91 -38.92 16.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.17 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.484 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.6 ttm180 -56.43 -26.07 52.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.597 179.85 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.42 -63.27 3.46 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.219 179.723 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.412 ' HA ' ' HB2' ' A' ' 44' ' ' TRP . . . -48.82 -24.36 1.41 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.791 0.329 . . . . 0.0 111.346 179.787 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.426 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.98 -57.17 13.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.348 -179.957 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.16 -24.75 62.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.89 0.376 . . . . 0.0 111.195 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.437 ' NE1' ' HA2' ' A' ' 72' ' ' GLY . 6.5 m95 -55.42 -44.69 76.5 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.253 -178.884 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.4 mt -99.11 -20.4 5.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.755 0.312 . . . . 0.0 111.706 -179.381 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.596 HD13 ' HG2' ' A' ' 57' ' ' PRO . 1.4 tt -55.48 -34.12 33.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.681 -179.086 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.23 -27.57 72.55 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.783 -0.723 . . . . 0.0 113.334 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -70.73 -0.04 8.04 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.356 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -91.51 -38.22 12.66 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 -179.829 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.568 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 69.57 44.96 0.84 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.272 0.558 . . . . 0.0 110.714 179.831 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.447 ' O ' HG23 ' A' ' 55' ' ' VAL . 4.9 m-20 -126.94 164.06 22.29 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.907 -179.843 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -61.57 -40.78 95.98 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.103 -179.866 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.503 ' HG3' HD22 ' A' ' 28' ' ' LEU . 14.0 ttm180 -67.25 -9.65 42.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.798 179.889 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.549 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -104.25 -8.89 19.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.14 -179.003 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 51' ' ' ASP . 71.2 t -91.72 -36.73 8.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.517 -179.767 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.608 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 13.5 tt0 -60.27 -51.93 76.74 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -179.395 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 51.0 Cg_exo -54.99 -17.67 14.87 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 122.273 1.982 . . . . 0.0 112.821 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.516 HD13 HD12 ' A' ' 77' ' ' LEU . 14.5 mt -85.82 -36.06 20.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.965 -179.76 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.6 mm -61.15 -53.34 50.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.801 -179.452 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -70.03 -13.71 62.35 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.88 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.677 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.9 mp -89.86 -36.36 15.11 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -177.961 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.572 HD13 HD22 ' A' ' 92' ' ' LEU . 9.0 mt -63.48 -9.16 11.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.836 0.351 . . . . 0.0 111.132 -178.34 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -111.78 -11.88 13.9 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.365 -179.823 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.424 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 3.0 t70 -61.07 -32.49 72.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.12 0.486 . . . . 0.0 111.111 179.978 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.4 t70 47.61 30.35 1.71 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.793 179.885 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.46 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 22.7 t -86.28 -36.26 19.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.864 0.364 . . . . 0.0 111.426 -179.767 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 130.2 -96.95 0.37 Allowed Glycine 0 C--O 1.228 -0.253 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 -178.875 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.06 -32.61 55.17 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.966 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.677 HG12 ' HG ' ' A' ' 61' ' ' LEU . 16.3 t -73.77 -59.99 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.032 179.286 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.418 ' HA ' ' O ' ' A' ' 61' ' ' LEU . 7.6 tmm_? -69.4 -63.33 1.09 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.675 -179.209 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 22.9 t -51.76 -24.89 6.51 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.005 0.431 . . . . 0.0 110.764 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.437 ' HA2' ' NE1' ' A' ' 44' ' ' TRP . . . -63.51 -61.25 6.43 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.699 -0.762 . . . . 0.0 111.714 179.347 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.51 -25.47 68.04 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.722 0.296 . . . . 0.0 110.973 179.243 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -52.42 -46.26 66.28 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.115 -179.366 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.468 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 11.5 ptp180 -81.34 -30.77 33.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.776 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.521 ' HA ' HE21 ' A' ' 79' ' ' GLN . 14.7 m -53.19 -44.14 67.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.353 -179.673 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.556 HD23 ' HE1' ' A' ' 89' ' ' MET . 9.0 mp -55.47 -59.61 4.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.836 179.766 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -52.37 -31.23 32.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.472 179.489 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.521 HE21 ' HA ' ' A' ' 76' ' ' SER . 34.0 mt-30 -62.95 -36.94 85.13 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.911 0.386 . . . . 0.0 110.395 179.631 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.568 HG23 ' HG3' ' A' ' 50' ' ' GLN . 69.2 mt -71.63 -55.2 14.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.543 179.432 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.564 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 63.12 -175.57 8.22 Favored Glycine 0 N--CA 1.453 -0.218 0 CA-C-N 115.979 -0.555 . . . . 0.0 113.383 179.407 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.595 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 73.49 168.35 14.98 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.349 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.445 ' HG3' HH21 ' A' ' 86' ' ' ARG . 40.2 tt0 -55.65 -21.12 16.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.927 0.394 . . . . 0.0 110.724 179.621 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.595 HH11 ' HA3' ' A' ' 82' ' ' GLY . 2.7 mpt_? -60.84 -65.6 0.66 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.242 -178.855 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.609 HG22 ' HE1' ' A' ' 89' ' ' MET . 2.5 p -70.88 -23.13 23.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.181 0.515 . . . . 0.0 110.105 179.492 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.445 HH21 ' HG3' ' A' ' 83' ' ' GLU . 23.2 ttp180 -54.61 -19.46 6.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.273 -179.815 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -79.56 -36.65 37.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.43 -35.87 72.76 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.606 179.607 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.609 ' HE1' HG22 ' A' ' 85' ' ' VAL . 8.4 mmt -59.23 -62.74 1.66 Allowed 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.86 178.987 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -51.56 -36.55 45.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.93 179.394 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -73.53 -28.16 61.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.589 -179.825 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.662 HD23 ' HB2' ' A' ' 104' ' ' ALA . 2.4 tp -86.19 -27.15 24.71 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.581 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.28 -28.28 64.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.684 179.039 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -80.14 -27.51 39.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.766 179.455 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.4 p -112.16 27.03 10.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.484 179.245 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.546 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -50.53 119.8 7.84 Favored Glycine 0 N--CA 1.448 -0.552 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.818 -178.852 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 t -142.58 130.68 21.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.521 -0.339 . . . . 0.0 110.42 179.05 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.92 -132.37 19.43 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.318 -179.567 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.07 -15.88 23.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.803 0.335 . . . . 0.0 110.588 179.998 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.454 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -56.93 -37.06 70.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.648 179.638 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.546 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 61.0 ttt180 -57.19 -61.28 2.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.343 179.458 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -53.32 -32.8 50.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.309 179.379 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.454 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 9.6 t -62.45 -51.94 66.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.499 179.974 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.662 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -56.15 -62.24 1.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -178.914 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 106' ' ' ASN . 6.0 p -57.77 -53.38 45.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.022 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.502 ' N ' HG13 ' A' ' 105' ' ' VAL . 41.2 t30 -61.83 -39.16 90.83 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -178.787 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.564 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 63.4 t80 -62.16 -23.96 66.9 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 120.836 0.35 . . . . 0.0 111.263 -178.613 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.2 mt -53.65 -22.78 9.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.411 -179.757 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -77.63 7.17 5.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.246 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.0 m -130.05 -52.97 1.12 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.444 -179.548 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.104 -0.95 . . . . 0.0 111.433 -179.95 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 mtt . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.739 0.305 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.92 -174.54 0.09 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.407 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -82.37 -13.41 56.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.902 -179.933 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -77.51 -66.37 0.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.76 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.52 138.3 34.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.895 179.843 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -142.89 -30.38 0.53 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.709 -179.958 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 11.3 p-90 -162.22 36.52 0.12 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.705 179.689 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.2 p -64.38 133.37 29.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.962 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.4 ptt180 50.96 20.41 0.79 Allowed 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.074 179.863 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.45 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 46.0 ttt180 -96.86 107.24 19.7 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.79 178.192 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.45 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 19.6 t70 74.92 -3.53 2.58 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 123.401 0.438 . . . . 0.0 110.702 -179.191 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.912 HG13 ' HB3' ' A' ' 15' ' ' ALA . 89.5 t -58.76 -82.85 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.998 -179.95 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 40.7 t 56.34 101.26 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.46 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 59.4 p 47.07 29.18 1.04 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.321 179.177 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.912 ' HB3' HG13 ' A' ' 12' ' ' VAL . . . -89.71 -0.27 57.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.851 179.597 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.48 HD22 ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -44.49 -22.03 0.06 Allowed 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.484 -179.363 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.474 ' H ' HD13 ' A' ' 16' ' ' LEU . 61.6 m -52.01 -40.33 60.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.882 0.372 . . . . 0.0 110.858 179.749 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -168.21 88.71 0.25 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.586 179.724 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.559 ' SD ' ' N ' ' A' ' 20' ' ' GLY . 0.0 OUTLIER -133.75 -35.15 0.99 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.671 -179.358 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.559 ' N ' ' SD ' ' A' ' 19' ' ' MET . . . 116.56 -109.72 2.0 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.696 -179.386 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.486 ' HA ' ' HB2' ' A' ' 24' ' ' PHE . 20.1 t70 -106.97 -11.5 15.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.673 0.273 . . . . 0.0 111.105 -179.7 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -59.21 -44.21 92.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.131 -179.371 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.538 ' HB3' ' SD ' ' A' ' 19' ' ' MET . . . -105.64 15.05 27.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.135 179.659 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.486 ' HB2' ' HA ' ' A' ' 21' ' ' ASP . 3.1 t80 -49.44 -44.65 45.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.537 178.902 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -63.48 -56.71 24.31 Favored Pre-proline 0 N--CA 1.465 0.297 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.307 -179.584 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 70.5 Cg_exo -37.39 -25.24 0.06 OUTLIER 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 122.863 2.376 . . . . 0.0 112.759 179.244 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 27.1 mt -72.33 -54.26 9.99 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.742 179.215 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.573 HD23 HD11 ' A' ' 46' ' ' ILE . 12.9 mt -67.96 -26.06 65.75 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.134 179.044 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 11.6 mm-40 -63.72 -41.04 98.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.497 -179.614 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.2 m -66.05 -15.45 63.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.578 -179.765 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.543 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 88.1 mt -67.63 -10.98 57.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.726 0.298 . . . . 0.0 111.056 -179.728 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.5 t -98.09 15.88 22.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.089 -179.868 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.478 ' ND2' ' HB ' ' A' ' 38' ' ' ILE . 23.2 p-10 -86.69 149.63 24.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.96 0.41 . . . . 0.0 111.12 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.74 -37.46 82.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.994 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.13 158.21 32.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.956 -179.796 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 1.5 p90 -106.25 -21.0 13.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.962 179.867 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -64.76 -51.57 61.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.799 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.478 ' HB ' ' ND2' ' A' ' 33' ' ' ASN . 43.0 mt -62.32 -40.41 87.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.439 179.614 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.543 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 31.1 ttm180 -63.12 -20.98 65.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.534 179.56 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.92 -64.53 3.86 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.549 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.56 -36.31 4.57 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.694 0.283 . . . . 0.0 111.498 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.23 -47.94 83.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.992 0.425 . . . . 0.0 110.338 179.438 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.04 -30.91 69.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.112 179.533 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -70.73 -34.01 71.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.519 -178.704 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 35.9 mt -98.32 -19.34 5.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.82 0.343 . . . . 0.0 111.502 -179.464 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.609 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -56.1 -35.63 42.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.136 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.21 -18.48 78.06 Favored Glycine 0 C--N 1.329 0.16 0 C-N-CA 120.566 -0.826 . . . . 0.0 113.592 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -58.16 -34.22 70.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.007 0.403 . . . . 0.0 111.098 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.438 ' C ' ' H ' ' A' ' 51' ' ' ASP . 12.0 m-85 -94.07 118.67 31.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.964 0.411 . . . . 0.0 110.963 179.593 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -72.13 20.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.81 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.438 ' H ' ' C ' ' A' ' 49' ' ' PHE . 28.7 t0 -83.8 137.25 33.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.754 0.311 . . . . 0.0 110.552 179.907 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -10.32 32.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.788 -179.044 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.486 ' HG2' HD11 ' A' ' 28' ' ' LEU . 12.3 ttt180 -62.28 -32.36 73.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.775 0.321 . . . . 0.0 110.652 -179.852 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.609 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -104.8 20.15 19.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.58 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.0 p -73.64 -38.66 52.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.823 0.344 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.452 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 19.2 tt0 -60.29 -53.35 65.71 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.591 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.477 ' O ' HD13 ' A' ' 61' ' ' LEU . 69.7 Cg_exo -38.91 -53.16 2.01 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.494 2.129 . . . . 0.0 112.635 179.702 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.515 ' HB3' HD21 ' A' ' 77' ' ' LEU . 11.6 mt -55.58 -48.29 75.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.5 -179.503 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 35.8 mm -58.03 -54.61 29.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.657 -179.46 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -69.81 -11.96 61.26 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.534 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.64 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.4 OUTLIER -87.46 -47.16 8.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.843 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.655 HD13 HD22 ' A' ' 92' ' ' LEU . 5.6 mt -56.24 -16.91 6.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.12 0.486 . . . . 0.0 110.846 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.06 -12.81 14.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.319 179.951 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.424 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.6 t0 -61.13 -35.52 77.28 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.18 0.514 . . . . 0.0 110.911 -179.958 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.65 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 42.9 m-20 52.59 29.95 7.93 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.747 179.792 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.469 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 43.9 t -84.36 -3.62 58.4 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.82 0.343 . . . . 0.0 111.028 179.892 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.88 -90.64 1.46 Allowed Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.434 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.79 -45.68 89.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.162 0.506 . . . . 0.0 109.801 179.435 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.64 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.3 t -69.19 -42.52 81.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.379 -179.873 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.65 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 0.9 OUTLIER -66.83 -62.84 1.24 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.023 -179.816 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.444 ' HA ' HH21 ' A' ' 70' ' ' ARG . 95.2 p -54.67 -24.94 23.97 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.005 179.715 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.58 -35.19 79.47 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.601 -179.915 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.467 ' O ' HD23 ' A' ' 77' ' ' LEU . . . -73.66 -38.61 64.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.556 0.217 . . . . 0.0 111.073 179.79 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.538 ' HB2' HH22 ' A' ' 70' ' ' ARG . . . -42.49 -42.06 3.17 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.027 -179.04 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -84.14 -31.23 25.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.285 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.7 m -63.06 -46.3 88.14 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.743 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.848 HD12 HG13 ' A' ' 85' ' ' VAL . 3.8 mm? -55.34 -60.93 2.72 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.73 0.3 . . . . 0.0 111.534 -178.909 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -61.25 -27.04 68.17 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.758 0.313 . . . . 0.0 111.459 179.807 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -70.55 -24.57 62.82 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.174 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.428 ' HB ' ' CG2' ' A' ' 85' ' ' VAL . 85.0 mt -74.86 -60.99 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.141 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 179.55 -135.68 2.58 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 119.911 -1.137 . . . . 0.0 113.711 -179.49 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.618 ' H ' HH11 ' A' ' 84' ' ' ARG . . . -127.51 -78.89 0.27 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 121.151 -0.547 . . . . 0.0 112.508 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -58.67 -21.27 53.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.82 0.343 . . . . 0.0 111.766 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.618 HH11 ' H ' ' A' ' 82' ' ' GLY . 4.3 mpt_? -75.97 -62.88 1.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.243 0.544 . . . . 0.0 110.28 -178.715 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.848 HG13 HD12 ' A' ' 77' ' ' LEU . 39.4 t -70.72 -20.43 22.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.988 179.653 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 23.3 ttm180 -46.47 -26.71 0.91 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.746 -179.939 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.5 -36.3 22.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.778 179.794 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.91 -44.26 77.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.36 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.433 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 4.3 ppp? -64.3 -28.69 69.89 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.912 0.387 . . . . 0.0 110.049 179.88 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.418 ' N ' ' SD ' ' A' ' 89' ' ' MET . 22.5 mt-10 -70.42 -37.6 74.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.636 179.015 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.471 ' O ' ' HD3' ' A' ' 91' ' ' LYS . 7.3 tmtm? -66.68 -33.83 76.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.393 179.358 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.655 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -85.84 -27.37 25.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.931 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.28 -30.37 69.41 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.456 179.064 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -80.18 -25.07 39.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.358 179.934 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 61.8 p -110.96 20.89 17.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.14 179.067 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.564 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -51.34 119.19 7.74 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.701 -178.902 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.1 m -152.67 130.27 11.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.545 -0.328 . . . . 0.0 110.503 179.189 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.46 -144.61 49.34 Favored Glycine 0 CA--C 1.518 0.275 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.481 -179.839 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -68.71 -29.33 67.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.81 0.338 . . . . 0.0 110.839 179.882 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.634 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.13 -41.73 49.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.519 -179.911 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.564 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 74.7 ttt180 -67.79 -54.49 18.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.524 -179.549 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -45.79 -28.51 1.08 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.281 -179.771 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.524 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 53.6 t -61.8 -60.19 3.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.057 179.242 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.593 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -53.54 -62.02 1.93 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.274 0.559 . . . . 0.0 111.776 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 46.3 t -54.41 -59.22 2.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.843 -178.643 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -56.84 -32.26 65.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.717 0.294 . . . . 0.0 111.612 -179.17 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.424 ' OH ' ' HA2' ' A' ' 82' ' ' GLY . 3.9 t80 -59.34 -27.88 66.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.047 0.451 . . . . 0.0 110.453 -179.678 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 41.8 mt -56.48 -22.25 31.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.398 179.884 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -56.04 -17.83 7.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.475 -179.887 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.1 p -93.7 -64.63 1.06 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.975 179.723 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.465 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 80.0 m80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.323 -0.846 . . . . 0.0 110.718 179.903 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ttt . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.862 0.363 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.3 -24.35 67.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.833 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -109.45 10.13 25.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.732 179.727 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 5' ' ' ASN . 9.9 tp10 61.99 99.69 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.101 179.961 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.441 ' HB3' ' O ' ' A' ' 4' ' ' GLU . 51.2 t30 74.54 -46.08 0.6 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.623 179.902 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.0 tttt 60.06 -92.7 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.637 0.256 . . . . 0.0 111.016 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.488 ' CD1' HG23 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -79.1 -157.87 0.13 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.714 179.717 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.488 HG23 ' CD1' ' A' ' 7' ' ' TRP . 17.0 t 74.59 -7.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 120.807 0.337 . . . . 0.0 111.044 -179.641 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -116.97 -28.77 6.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.051 179.759 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 39.2 ptt180 -55.31 124.72 17.99 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.071 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 8.0 m-20 75.38 -25.7 0.2 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.674 -179.769 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.551 HG12 ' H ' ' A' ' 13' ' ' SER . 1.8 t -80.86 -143.5 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.569 -179.898 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.551 ' H ' HG12 ' A' ' 12' ' ' VAL . 17.5 p 62.98 20.04 12.02 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.762 0.315 . . . . 0.0 110.959 -179.858 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.488 HG22 ' O ' ' A' ' 12' ' ' VAL . 1.7 t -174.26 98.59 0.1 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.166 179.621 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 23' ' ' ALA . . . -95.94 -73.1 0.6 Allowed 'General case' 0 C--O 1.231 0.111 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.851 -179.712 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.538 HD12 ' H ' ' A' ' 17' ' ' SER . 0.5 OUTLIER -89.9 -67.49 0.84 Allowed 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.681 178.945 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.538 ' H ' HD12 ' A' ' 16' ' ' LEU . 69.5 p -91.85 -52.56 4.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.307 0.575 . . . . 0.0 110.15 178.316 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 171.97 53.75 0.0 OUTLIER 'General case' 0 C--O 1.232 0.162 0 CA-C-N 114.557 -1.201 . . . . 0.0 109.486 -179.494 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.468 ' SD ' ' HB2' ' A' ' 23' ' ' ALA . 19.8 mtp -109.43 -44.52 3.88 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.18 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.669 ' H ' ' H ' ' A' ' 15' ' ' ALA . . . 93.31 -139.66 14.69 Favored Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.83 -179.928 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -57.91 -28.1 63.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.762 0.315 . . . . 0.0 111.37 -179.751 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -61.96 -30.2 70.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.128 -179.874 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . . . -104.73 19.11 21.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.653 -179.692 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.437 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -58.0 -51.77 68.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 179.698 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.428 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.39 -54.02 47.71 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.725 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 89.5 Cg_exo -40.1 -35.94 1.34 Allowed 'Trans proline' 0 C--N 1.362 1.272 0 C-N-CA 122.177 1.918 . . . . 0.0 111.433 -179.955 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 27.1 mt -66.86 -53.91 27.65 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.985 178.501 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 31' ' ' LEU . 35.5 tp -61.65 -19.95 62.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.823 179.34 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -75.73 -43.25 47.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.21 -179.614 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.7 m -65.98 -14.37 61.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.363 -179.689 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.528 HD11 HG13 ' A' ' 46' ' ' ILE . 65.9 mt -70.33 -10.43 58.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.271 -179.918 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.6 p -101.79 10.32 40.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.701 179.795 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -81.65 145.76 30.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.76 -18.13 64.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.893 -179.957 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -77.71 142.15 38.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.921 -179.947 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 12.3 p90 -96.59 -22.2 17.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.148 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -72.2 -37.72 69.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.018 0.437 . . . . 0.0 110.693 -179.981 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.546 ' N ' HD12 ' A' ' 38' ' ' ILE . 1.8 mp -81.66 -36.13 14.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.736 -179.766 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.523 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 20.3 ttm180 -65.19 -25.51 67.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.489 -179.955 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.19 -64.59 3.05 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.509 -179.995 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.65 -39.48 24.38 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.661 0.267 . . . . 0.0 110.911 179.76 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 46' ' ' ILE . . . -57.25 -55.39 35.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.236 179.298 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.44 -33.93 71.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.255 179.209 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -64.97 -30.17 71.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.181 -179.814 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.434 ' O ' ' HB2' ' A' ' 48' ' ' ASN . 66.4 mt -98.73 -18.91 6.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.312 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.528 HG13 HD11 ' A' ' 31' ' ' LEU . 4.5 mm -50.41 -61.19 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.315 -179.234 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.677 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -68.56 -3.42 33.3 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.85 -0.691 . . . . 0.0 113.992 -178.395 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.434 ' HB2' ' O ' ' A' ' 45' ' ' ILE . 3.8 m-20 -70.74 0.22 7.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 117.242 0.521 . . . . 0.0 111.078 -179.964 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -106.07 -23.01 12.73 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -179.747 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.614 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.5 OUTLIER 62.32 20.48 11.83 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.899 0.38 . . . . 0.0 110.946 -179.683 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -96.82 171.9 8.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.149 -179.874 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.427 ' O ' HG12 ' A' ' 55' ' ' VAL . 27.4 tt0 -66.41 -34.12 77.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.161 179.738 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -66.73 -13.23 61.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.963 0.411 . . . . 0.0 111.09 -179.719 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.458 ' HA ' HG23 ' A' ' 46' ' ' ILE . . . -101.68 6.38 41.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.928 -179.304 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 52' ' ' GLU . 1.3 p -92.24 -39.11 11.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.242 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.571 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 35.7 tt0 -60.26 -51.9 76.98 Favored Pre-proline 0 CA--C 1.53 0.211 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -178.99 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.571 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 88.1 Cg_exo -47.07 -49.21 13.07 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 121.881 1.721 . . . . 0.0 111.615 179.507 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.442 HD13 ' HG ' ' A' ' 77' ' ' LEU . 10.3 mt -56.77 -37.37 70.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.376 -179.697 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 55' ' ' VAL . 46.6 mm -61.89 -59.33 4.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.901 0.382 . . . . 0.0 111.985 -179.396 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.3 mmmt -70.02 -9.72 56.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.32 -178.873 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.679 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -87.46 -44.34 11.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -178.327 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.713 HD13 HD22 ' A' ' 92' ' ' LEU . 7.6 mt -59.19 -11.32 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.095 0.474 . . . . 0.0 110.641 -179.119 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -116.03 -14.84 11.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.153 -179.926 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -61.23 -22.95 65.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.248 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.57 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 4.0 p30 41.51 32.28 0.22 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.411 -0.813 . . . . 0.0 112.153 179.786 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.471 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 22.2 t -86.18 -8.73 57.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.195 -179.998 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.89 -86.03 1.09 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.248 -179.765 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.45 -42.95 99.56 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.103 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.679 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.2 t -68.69 -49.29 65.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.338 -179.766 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.57 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 51.5 ttp180 -62.7 -41.48 99.16 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.233 -179.758 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 80.5 p -64.26 -31.51 72.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.995 -179.858 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.21 -28.56 69.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.515 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.576 ' HB2' ' CB ' ' A' ' 61' ' ' LEU . . . -74.3 -58.55 3.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.655 0.264 . . . . 0.0 111.588 -179.844 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.509 ' HA ' HD12 ' A' ' 77' ' ' LEU . . . -60.1 -23.93 64.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.833 -179.204 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.6 ttt-85 -81.39 -47.86 12.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.722 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.677 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 8.7 m -67.22 -30.13 69.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.754 -179.494 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 74' ' ' ALA . 18.3 mt -60.76 -59.81 4.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.833 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -54.45 -36.3 63.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.234 179.392 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -58.93 -37.36 76.51 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.918 0.39 . . . . 0.0 110.913 179.718 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.614 HG12 ' HG3' ' A' ' 50' ' ' GLN . 98.3 mt -71.97 -60.32 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.924 179.856 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 67.96 123.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.632 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.589 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 142.93 175.51 16.11 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.68 179.873 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -65.85 -26.15 67.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.761 0.315 . . . . 0.0 111.11 -179.988 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.589 HH11 ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -61.84 -54.31 43.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.665 -179.405 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.581 HG11 ' HB ' ' A' ' 80' ' ' ILE . 3.4 m -70.71 -23.8 24.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.84 0.352 . . . . 0.0 111.306 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.506 ' HA ' ' HG2' ' A' ' 89' ' ' MET . 68.5 ttt180 -58.64 -40.87 84.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.968 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.78 -33.45 70.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.738 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.22 -34.23 77.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.412 179.526 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.527 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 17.6 mmm -69.27 -55.44 10.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.042 -0.527 . . . . 0.0 109.981 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -54.03 -33.53 57.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.4 179.377 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -79.24 -22.84 44.22 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.683 179.242 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.713 HD22 HD13 ' A' ' 62' ' ' LEU . 1.8 tp -87.16 -30.67 20.87 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.707 179.858 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.77 -32.17 69.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.527 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.473 ' HG3' HG23 ' A' ' 95' ' ' THR . 12.9 pt-20 -80.39 -20.97 42.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.09 0.472 . . . . 0.0 110.15 179.853 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.473 HG23 ' HG3' ' A' ' 94' ' ' GLU . 45.1 p -119.23 28.8 8.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.677 179.015 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -52.66 120.98 13.16 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.222 -0.899 . . . . 0.0 113.75 -178.862 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.3 t -140.63 130.68 24.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.727 0.299 . . . . 0.0 110.334 178.895 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.46 -134.71 22.9 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.54 -0.838 . . . . 0.0 111.994 -179.463 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -93.85 -12.29 29.28 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.813 0.34 . . . . 0.0 110.541 179.698 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.653 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.8 -41.17 66.98 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.738 179.454 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -60.48 -56.64 18.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.051 179.86 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -48.56 -23.13 0.89 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.66 179.774 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.571 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 41.8 t -78.19 -55.83 9.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.646 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.65 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -52.93 -41.31 64.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.167 0.508 . . . . 0.0 112.206 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.43 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 85.2 t -64.89 -60.03 3.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.74 -178.318 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -65.54 -47.86 74.44 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.612 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.527 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 67.6 t80 -60.13 -22.63 63.08 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.666 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 4.6 mt -59.48 -20.83 58.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.602 -179.718 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -73.1 -9.7 59.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.338 -179.785 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 69.3 p -127.99 23.67 6.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.204 -179.992 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 26.4 m80 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.998 179.724 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.876 0.369 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.72 -22.94 67.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.429 -179.743 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -127.07 48.44 2.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.95 0.405 . . . . 0.0 110.822 -179.751 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 60.63 -85.59 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.333 179.896 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 44.4 t30 -145.13 112.04 5.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.776 0.322 . . . . 0.0 110.949 179.95 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.9 mmmt -137.92 9.3 2.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.047 179.992 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -162.66 107.5 1.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.987 0.422 . . . . 0.0 111.358 -179.97 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.416 ' O ' HG22 ' A' ' 8' ' ' VAL . 9.8 p -170.71 18.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.733 179.847 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -163.71 -31.76 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.964 -179.758 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.42 ' NE ' ' HA ' ' A' ' 10' ' ' ARG . 4.4 mmp_? -47.93 116.7 1.59 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.579 179.625 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.4 t70 77.52 -37.45 0.25 Allowed 'General case' 0 N--CA 1.464 0.259 0 O-C-N 123.656 0.598 . . . . 0.0 111.436 -179.936 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.48 HG11 ' HA ' ' A' ' 23' ' ' ALA . 94.8 t -64.2 135.49 27.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.052 0.453 . . . . 0.0 111.536 -179.621 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.4 t -159.58 -51.32 0.06 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.42 179.726 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.9 t -131.07 17.51 5.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.674 179.579 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -88.61 -1.56 58.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.982 179.825 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.465 HD22 ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -48.15 -19.04 0.24 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.927 -179.911 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.456 ' H ' HD13 ' A' ' 16' ' ' LEU . 87.8 p -47.14 -39.43 13.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.473 179.997 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 18' ' ' ARG . 8.9 tpt180 -178.69 89.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.304 -179.446 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -134.04 -43.62 0.8 Allowed 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.517 179.623 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.53 -134.66 6.96 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.739 -179.737 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.409 ' HA ' ' HB2' ' A' ' 24' ' ' PHE . 12.7 m-20 -84.48 -28.45 26.76 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.852 0.358 . . . . 0.0 111.074 -179.804 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -58.87 -31.46 68.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.174 -179.811 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -105.47 6.03 32.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.738 -179.505 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.644 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 14.0 t80 -63.43 -44.84 93.43 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.468 ' HG3' ' NH1' ' A' ' 53' ' ' ARG . 3.2 mt-10 -53.39 -54.18 48.12 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.158 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 98.9 Cg_exo -43.11 -18.18 0.11 Allowed 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.719 2.279 . . . . 0.0 113.09 -179.998 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.577 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.8 mt -80.06 -58.15 3.29 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.323 179.724 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.6 -16.24 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.854 179.291 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -69.16 -30.96 69.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.621 178.901 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.4 t -66.45 -16.76 64.36 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.147 179.462 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.8 mt -62.42 -6.78 3.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.131 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.3 m -120.26 23.42 10.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.455 -179.566 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.425 HD21 ' N ' ' A' ' 39' ' ' ARG . 52.0 p-10 -90.15 150.52 21.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.33 -179.749 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -65.88 -35.17 79.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.031 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -75.96 156.48 34.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.206 -179.624 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -106.49 -33.94 7.54 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.098 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.498 ' HG3' HG13 ' A' ' 38' ' ' ILE . 33.2 ptt180 -59.79 -40.18 87.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.045 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.498 HG13 ' HG3' ' A' ' 37' ' ' ARG . 60.0 mt -77.69 -37.63 24.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.8 179.865 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.503 HH12 HD11 ' A' ' 61' ' ' LEU . 2.1 tmt_? -58.44 -22.96 56.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.379 179.416 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -78.88 -50.17 6.07 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.336 179.775 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.38 -34.25 23.5 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.836 0.35 . . . . 0.0 110.81 179.695 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.496 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -60.99 -55.14 36.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.202 179.291 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.4 ' O ' HG22 ' A' ' 46' ' ' ILE . . . -64.19 -25.97 68.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.953 179.459 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.5 m95 -70.63 -37.43 73.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.234 -178.938 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 52.7 mt -99.17 -19.53 5.87 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-O 120.969 0.414 . . . . 0.0 111.755 -178.66 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.624 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.0 tt -56.82 -36.02 48.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.489 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.521 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -77.97 -22.15 69.45 Favored Glycine 0 CA--C 1.518 0.242 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.369 -178.996 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -70.75 2.14 4.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.352 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.444 ' HB3' ' OD2' ' A' ' 51' ' ' ASP . 36.8 m-85 -107.97 -25.42 11.18 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.788 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.581 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.9 mp0 63.76 39.64 8.33 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.12 0.486 . . . . 0.0 110.942 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.444 ' OD2' ' HB3' ' A' ' 49' ' ' PHE . 2.8 m-20 -100.8 169.51 8.95 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.532 -179.499 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.555 ' O ' HG22 ' A' ' 55' ' ' VAL . 8.7 pt-20 -66.48 -40.39 89.3 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.423 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.468 ' NH1' ' HG3' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -69.34 -8.7 48.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.658 0.266 . . . . 0.0 110.741 179.806 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.644 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -87.84 -35.99 17.47 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.584 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 52' ' ' GLU . 35.1 m -64.5 -39.57 86.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -178.003 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.653 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 3.6 tp10 -59.44 -54.2 58.37 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -178.641 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.653 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 80.1 Cg_exo -46.34 -52.11 7.76 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.297 1.998 . . . . 0.0 112.476 179.62 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.511 HD22 ' HA ' ' A' ' 73' ' ' ALA . 12.3 mt -53.65 -29.03 36.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.915 -179.14 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.0 mm -63.43 -60.73 2.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.43 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -70.1 -10.58 59.2 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -178.969 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.745 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.6 OUTLIER -83.02 -49.59 9.4 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.481 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.717 HD13 HD22 ' A' ' 92' ' ' LEU . 12.7 mt -56.39 -9.92 0.81 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.494 -179.311 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -123.78 -8.53 7.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.034 179.593 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.441 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 3.3 t70 -61.11 -38.83 87.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.074 0.464 . . . . 0.0 111.275 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.521 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 49.7 m-20 64.14 24.7 13.52 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.257 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.502 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.0 OUTLIER -83.91 7.64 17.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.291 -179.974 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.6 -78.32 0.73 Allowed Glycine 0 C--N 1.33 0.196 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.492 179.946 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -51.07 66.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.286 0.565 . . . . 0.0 109.969 179.422 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.745 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.8 t -62.63 -43.76 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.379 -179.8 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.521 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 37.8 ttp180 -66.77 -60.12 2.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.238 -179.686 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.0 m -51.51 -28.02 12.34 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.174 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -60.98 -46.01 95.44 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.184 179.702 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.511 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -66.96 -35.89 80.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.764 0.316 . . . . 0.0 111.085 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.17 -46.98 72.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.453 -179.691 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.413 ' HB2' ' NE2' ' A' ' 79' ' ' GLN . 7.8 ptp180 -78.88 -36.3 42.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.448 -179.688 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.521 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 58.8 m -59.37 -41.98 90.55 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.409 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.704 HD11 HD11 ' A' ' 62' ' ' LEU . 11.5 mt -61.1 -60.82 3.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.768 0.318 . . . . 0.0 110.718 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.451 ' HA ' ' CD1' ' A' ' 107' ' ' TYR . 34.0 mt-10 -53.77 -33.24 55.22 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.557 178.726 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.413 ' NE2' ' HB2' ' A' ' 75' ' ' ARG . 33.5 mt-30 -63.2 -42.48 99.33 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.853 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.581 HG23 ' HG3' ' A' ' 50' ' ' GLN . 91.7 mt -64.32 -60.39 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.21 179.117 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.59 133.32 0.05 OUTLIER Glycine 0 CA--C 1.518 0.251 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.881 179.782 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 133.39 164.36 10.76 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.586 179.822 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.4 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 12.7 pt-20 -65.19 -22.43 66.9 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.782 0.325 . . . . 0.0 110.738 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.638 ' HD3' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -60.57 -53.42 57.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 -179.998 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.638 ' N ' ' HD3' ' A' ' 84' ' ' ARG . 2.3 t -70.81 -26.14 27.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.053 0.454 . . . . 0.0 110.245 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.48 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 74.2 ttt180 -52.44 -31.9 36.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.756 -179.84 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.11 92.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.393 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.09 -35.94 78.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.219 179.34 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.668 ' HE1' HG12 ' A' ' 103' ' ' VAL . 8.2 mmm -67.8 -43.08 80.51 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.568 179.05 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 14.4 mm-40 -57.39 -36.4 71.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.724 178.494 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -75.89 -28.74 58.23 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.29 179.771 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.717 HD22 HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -87.16 -23.24 24.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.935 0.398 . . . . 0.0 110.428 179.817 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.15 -29.88 70.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.382 -179.843 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.516 ' HG3' HG23 ' A' ' 95' ' ' THR . 11.3 pt-20 -80.22 -23.23 41.04 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.975 0.417 . . . . 0.0 110.291 179.741 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.516 HG23 ' HG3' ' A' ' 94' ' ' GLU . 73.9 p -111.87 19.63 17.75 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.794 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.57 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -52.18 119.67 9.55 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 114.952 -1.022 . . . . 0.0 113.306 -179.201 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.3 t -144.1 130.35 19.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.813 0.339 . . . . 0.0 111.007 179.205 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.63 -131.01 50.74 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.902 179.936 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -77.36 -27.76 52.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.722 0.296 . . . . 0.0 111.278 -179.792 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.632 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.93 -31.42 50.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.68 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.57 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 47.8 ttt180 -75.31 -52.46 10.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.373 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -48.22 -22.0 0.59 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.268 0.556 . . . . 0.0 110.454 179.651 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.668 HG12 ' HE1' ' A' ' 89' ' ' MET . 49.1 t -69.05 -60.17 2.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.524 179.738 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.663 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.23 -46.97 84.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.179 0.514 . . . . 0.0 112.227 -179.596 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 59.5 t -64.88 -63.15 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -178.069 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -55.42 -37.3 67.48 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.199 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.585 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 22.9 t80 -61.5 -23.76 66.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.975 0.417 . . . . 0.0 111.421 -178.705 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 74.5 mt -58.1 -25.47 61.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.661 -179.478 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -85.38 0.45 52.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.522 -179.6 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 47.3 p -145.54 29.27 1.14 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -179.585 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.153 -0.927 . . . . 0.0 111.043 179.927 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.8 tpt . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.8 0.333 . . . . 0.0 110.794 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -113.88 1.59 14.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.288 -179.911 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -109.99 -62.72 1.47 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.821 179.901 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.16 150.39 48.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.791 179.895 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 43.3 t30 59.34 93.84 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.311 179.932 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -98.08 -32.89 11.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.882 179.934 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 58.4 m95 -75.61 83.67 2.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.669 179.915 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.616 ' HA ' ' HB2' ' A' ' 22' ' ' GLU . 1.6 p -177.41 -53.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.643 -179.613 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.455 ' H ' HG13 ' A' ' 8' ' ' VAL . 0.0 OUTLIER -107.85 21.74 16.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.172 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptp180 -59.95 108.7 0.8 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.998 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.2 t70 73.05 -0.85 3.24 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.333 -178.98 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.722 HG12 ' H ' ' A' ' 13' ' ' SER . 1.5 t -108.91 -165.91 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.207 179.743 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.722 ' H ' HG12 ' A' ' 12' ' ' VAL . 42.9 t -156.82 -69.65 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.739 0.304 . . . . 0.0 110.52 179.916 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.4 p -75.28 90.62 2.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.975 0.417 . . . . 0.0 110.253 179.32 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.674 ' HA ' ' HG3' ' A' ' 19' ' ' MET . . . -85.86 -60.75 1.92 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.063 -178.969 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.444 HD22 ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -55.66 -13.85 1.87 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.88 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.49 ' O ' ' HB2' ' A' ' 18' ' ' ARG . 38.7 t -61.84 -52.75 62.87 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 121.115 -0.234 . . . . 0.0 111.111 -179.679 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 17' ' ' SER . 63.0 ttt180 169.65 92.32 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 O-C-N 123.574 0.546 . . . . 0.0 110.235 179.939 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.674 ' HG3' ' HA ' ' A' ' 15' ' ' ALA . 1.9 mmt -133.22 -28.22 1.52 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.077 -179.531 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.33 139.25 0.69 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.098 -179.515 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 66.68 -77.36 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.201 0.524 . . . . 0.0 110.751 -179.483 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.616 ' HB2' ' HA ' ' A' ' 8' ' ' VAL . 10.4 pt-20 -57.78 -32.62 67.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.156 179.834 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.637 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -87.94 -6.72 57.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.849 -179.221 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.9 t80 -59.14 -56.21 25.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.698 -179.693 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.439 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.41 -51.26 69.08 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-O 119.216 -0.421 . . . . 0.0 111.724 179.979 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.637 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 59.8 Cg_exo -39.23 -29.65 0.22 Allowed 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 122.285 1.99 . . . . 0.0 111.254 179.174 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.9 mt -73.85 -55.18 6.52 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.726 -1.124 . . . . 0.0 109.339 177.882 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.52 HD22 HD12 ' A' ' 31' ' ' LEU . 3.0 tm? -53.33 -46.52 69.5 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.844 178.538 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -62.72 -41.87 99.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.738 179.931 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.558 ' HA ' ' HB2' ' A' ' 33' ' ' ASN . 47.4 t -66.37 -12.27 55.91 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.061 -179.278 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.52 HD12 HD22 ' A' ' 28' ' ' LEU . 49.0 mt -57.44 -24.3 54.78 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.915 0.388 . . . . 0.0 110.688 -179.774 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 71.3 p -125.8 21.81 7.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.628 179.723 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.558 ' HB2' ' HA ' ' A' ' 30' ' ' SER . 26.3 t-20 -57.36 141.22 47.86 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.074 -179.747 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.25 -43.51 96.07 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.731 -179.948 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -77.95 137.64 38.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.593 179.526 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 21.3 m95 -76.86 -29.79 56.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.146 -179.661 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -62.97 -45.29 93.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.875 179.902 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.6 mm -67.37 -36.06 75.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.766 179.771 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.609 HH12 HD21 ' A' ' 61' ' ' LEU . 1.3 tpm_? -64.9 -34.52 78.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.636 179.738 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.17 -64.46 2.99 Favored Glycine 0 C--N 1.33 0.204 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.751 -179.873 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.32 -33.91 9.68 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.732 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.576 ' HB3' HH21 ' A' ' 39' ' ' ARG . . . -63.64 -56.35 16.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.78 0.324 . . . . 0.0 110.782 179.967 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.27 -26.05 68.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.077 179.539 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.9 m95 -70.55 -39.72 73.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.526 -178.762 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.8 mt -98.88 -19.08 6.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.842 0.353 . . . . 0.0 111.868 -178.515 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.636 HD13 ' HG2' ' A' ' 57' ' ' PRO . 5.4 tt -53.9 -36.44 30.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.044 -178.996 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.27 -17.58 74.27 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.179 -179.551 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -70.33 -7.26 41.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.703 0.251 . . . . 0.0 111.58 -179.486 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -94.15 -24.92 17.34 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.598 0.237 . . . . 0.0 111.476 -179.905 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.654 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.7 mp0 60.74 30.28 19.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.382 179.485 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.46 ' O ' HG23 ' A' ' 55' ' ' VAL . 11.2 t70 -102.67 162.27 13.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.733 179.844 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -61.35 -36.23 79.63 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.011 -179.829 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.412 ' HG3' HD23 ' A' ' 28' ' ' LEU . 35.0 ttm180 -67.33 -9.61 42.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.026 0.441 . . . . 0.0 110.457 179.634 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.92 -7.99 21.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.558 -179.795 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.46 HG23 ' O ' ' A' ' 51' ' ' ASP . 21.4 t -90.22 -35.2 7.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.005 -179.769 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.525 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 20.6 tt0 -60.16 -48.44 94.31 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.341 -179.926 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.636 ' HG2' HD13 ' A' ' 46' ' ' ILE . 83.7 Cg_exo -46.18 -48.44 13.04 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 122.341 2.027 . . . . 0.0 112.094 179.365 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.451 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 1.7 mt -56.04 -33.06 64.62 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.8 -179.468 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 39.8 mm -57.16 -60.8 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.066 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -38.29 75.16 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.974 0.416 . . . . 0.0 111.826 -179.488 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.708 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.6 mp -57.08 -49.37 76.07 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -178.389 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.565 ' HB3' HD22 ' A' ' 92' ' ' LEU . 34.5 mt -60.44 -9.58 3.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.272 0.558 . . . . 0.0 110.008 -179.672 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -117.58 -12.0 10.39 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.843 179.511 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.522 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 6.5 t70 -61.05 -48.37 82.06 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.233 0.54 . . . . 0.0 111.152 -179.499 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.477 ' HB2' ' NH2' ' A' ' 70' ' ' ARG . 20.3 t70 68.98 21.39 7.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.806 179.447 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.48 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 36.2 m -86.22 12.14 10.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.265 -179.785 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.3 -100.78 1.42 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.614 179.712 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -46.27 -36.61 6.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.155 0.502 . . . . 0.0 110.512 179.762 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.708 HG12 ' HG ' ' A' ' 61' ' ' LEU . 16.4 t -73.57 -47.23 45.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.989 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.477 ' NH2' ' HB2' ' A' ' 65' ' ' ASP . 14.0 ttm180 -71.75 -61.76 1.66 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.651 0.263 . . . . 0.0 111.542 -179.48 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 87.6 p -50.56 -31.16 14.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.341 -179.706 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -62.66 -39.42 97.9 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.734 179.919 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.451 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -73.49 -30.03 62.89 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.599 0.238 . . . . 0.0 111.363 -179.983 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.8 -46.22 74.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.643 -179.591 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.1 ptp180 -79.28 -17.09 55.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.384 -179.716 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.0 t -63.82 -44.34 93.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.285 179.778 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.449 HD12 HD13 ' A' ' 58' ' ' LEU . 6.4 mp -58.95 -60.26 4.15 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.77 0.319 . . . . 0.0 111.138 179.997 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.402 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 3.7 tm-20 -50.92 -39.17 53.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.151 179.651 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -55.98 -38.37 70.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.339 -179.876 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.654 HG12 ' HG3' ' A' ' 50' ' ' GLN . 61.2 mt -86.95 -60.63 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.425 -179.767 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.82 93.81 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.512 -179.858 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.484 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 179.48 -174.16 45.96 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.779 -179.888 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -67.81 -31.93 72.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.891 0.376 . . . . 0.0 111.202 -179.7 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.549 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -60.44 -56.22 24.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.088 -179.814 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.549 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.6 OUTLIER -70.83 -20.69 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.839 0.352 . . . . 0.0 110.889 179.488 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.474 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 2.2 tmt_? -55.81 -31.98 63.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.801 179.404 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.421 ' O ' ' HG3' ' A' ' 90' ' ' GLU . . . -76.99 -23.94 52.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.865 179.801 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.24 -44.68 64.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.749 179.676 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.529 ' SD ' ' N ' ' A' ' 90' ' ' GLU . 2.3 ppp? -71.93 -30.58 65.48 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.276 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.529 ' N ' ' SD ' ' A' ' 89' ' ' MET . 1.0 OUTLIER -75.91 -29.19 58.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.936 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -72.05 -30.62 65.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.907 178.851 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.764 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.4 OUTLIER -87.33 -31.8 19.98 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.285 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.49 -24.98 61.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.408 178.807 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.21 -26.58 39.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.12 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 68.0 p -121.54 27.6 8.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.43 179.024 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -54.09 125.12 32.51 Favored Glycine 0 N--CA 1.448 -0.539 0 CA-C-N 115.086 -0.961 . . . . 0.0 113.683 -178.822 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.1 t -150.25 130.34 13.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.897 0.379 . . . . 0.0 111.033 179.129 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.22 -146.92 42.71 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.895 179.895 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.13 -28.71 62.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.672 0.272 . . . . 0.0 111.404 -179.805 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.679 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -55.25 -53.84 50.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.704 -179.79 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 39.4 ttp180 -55.24 -61.04 2.59 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.249 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 23.5 ttpp -45.67 -30.59 1.6 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.484 -179.174 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.535 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 4.8 t -65.06 -59.08 4.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.715 -179.82 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.764 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -51.39 -60.4 3.18 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.293 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 92.2 t -57.96 -61.24 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.447 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.401 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 12.0 m120 -55.49 -29.73 59.34 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.804 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.402 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 5.2 t80 -60.28 -33.07 71.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.135 0.493 . . . . 0.0 110.499 -179.899 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.433 HD21 ' SD ' ' A' ' 89' ' ' MET . 74.5 mt -55.24 -13.43 1.31 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.865 -179.419 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.504 ' HG3' HG23 ' A' ' 110' ' ' THR . 9.0 pt-20 -78.42 5.22 11.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.553 -179.998 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.504 HG23 ' HG3' ' A' ' 109' ' ' GLU . 70.0 p -144.98 7.06 1.19 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.436 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.824 -179.993 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.737 0.303 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.16 -31.5 0.2 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.248 -179.905 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -145.01 7.63 1.21 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 -179.872 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -115.24 -67.27 1.01 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.821 179.945 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -97.4 102.67 14.48 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.734 179.75 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -135.12 -171.51 2.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.176 179.976 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 2.0 p90 32.49 87.73 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.554 0.534 . . . . 0.0 112.193 179.543 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.7 p -152.32 130.47 2.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.364 179.927 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 63.96 4.36 1.97 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.956 179.635 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.438 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 32.9 ptt180 -72.25 116.45 12.7 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.163 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.438 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 25.6 t70 77.03 -49.69 0.55 Allowed 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.995 -179.282 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.694 HG12 ' H ' ' A' ' 13' ' ' SER . 2.4 t -68.32 176.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.546 179.878 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.694 ' H ' HG12 ' A' ' 12' ' ' VAL . 78.6 p -156.84 -3.27 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.707 0.289 . . . . 0.0 110.963 179.893 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.637 ' HB ' ' HB3' ' A' ' 17' ' ' SER . 1.5 m -85.93 166.62 15.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.282 179.435 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.441 ' H ' HG22 ' A' ' 14' ' ' THR . . . -95.3 -67.85 0.83 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.402 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.5 mt -83.5 -13.96 53.45 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.079 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.637 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 43.6 t -58.78 -52.06 67.3 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.593 -179.257 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.521 HH21 ' ND2' ' A' ' 48' ' ' ASN . 42.9 ttm180 -177.42 117.57 0.1 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.792 0.329 . . . . 0.0 111.379 -179.528 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.539 ' HB2' ' H ' ' A' ' 23' ' ' ALA . 14.8 mmt -122.0 -13.0 8.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.438 179.177 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.77 -17.07 47.6 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.835 179.727 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -174.23 -41.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.835 0.35 . . . . 0.0 111.02 -179.766 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.503 ' HB3' ' HB3' ' A' ' 19' ' ' MET . 30.5 tt0 -62.77 -29.66 70.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.487 -179.592 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.539 ' H ' ' HB2' ' A' ' 19' ' ' MET . . . -100.68 -3.75 29.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.67 -179.614 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.09 -52.95 62.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 110.316 179.449 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -63.37 -54.98 39.56 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.19 179.703 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 43.7 Cg_exo -51.74 -19.49 7.94 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.754 1.636 . . . . 0.0 110.758 179.733 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.662 HD21 ' HA ' ' A' ' 46' ' ' ILE . 1.4 tp -87.05 -36.06 18.39 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.416 179.809 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.64 HD12 HD12 ' A' ' 31' ' ' LEU . 21.1 tp -81.94 -22.48 36.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.338 -179.942 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.452 ' HG2' ' HA ' ' A' ' 26' ' ' PRO . 0.7 OUTLIER -74.91 -32.25 61.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.864 0.364 . . . . 0.0 110.998 -179.407 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 93.7 p -66.44 -20.05 65.95 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.41 -179.872 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.64 HD12 HD12 ' A' ' 28' ' ' LEU . 81.4 mt -66.19 -7.83 20.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.263 -179.824 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 98.2 p -106.91 21.82 16.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.826 179.769 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -84.7 142.99 29.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.08 -179.918 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -67.19 -17.53 64.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.597 179.746 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -86.36 156.63 20.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.659 179.835 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.9 p-90 -100.66 -34.29 9.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.427 -179.53 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -64.82 -44.74 88.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.774 0.321 . . . . 0.0 111.098 -179.901 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.4 mt -63.8 -42.92 97.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.717 -179.896 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -63.99 -21.63 66.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.553 179.765 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.12 -61.09 7.01 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.508 179.856 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.75 -34.77 28.49 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.737 0.303 . . . . 0.0 111.211 179.832 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.5 -56.72 18.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.709 179.729 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.37 -32.69 72.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.56 179.426 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.8 m95 -70.7 -29.33 65.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.466 -179.313 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.1 mt -99.02 -25.04 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-O 120.931 0.395 . . . . 0.0 111.574 -179.06 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.662 ' HA ' HD21 ' A' ' 27' ' ' LEU . 2.8 tt -60.55 -28.13 41.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.502 -178.792 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.569 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -66.23 -26.1 72.48 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.489 179.777 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.521 ' ND2' HH21 ' A' ' 18' ' ' ARG . 4.5 m-20 -53.14 -39.65 63.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.398 . . . . 0.0 110.159 179.615 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -87.54 119.58 27.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.275 179.203 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.417 ' HG2' HG23 ' A' ' 80' ' ' ILE . 51.8 mt-30 -81.79 24.99 0.57 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.674 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -83.94 163.09 20.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.096 -179.8 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.45 -25.97 66.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.183 -179.805 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.436 ' HD3' HD22 ' A' ' 28' ' ' LEU . 18.7 ttm180 -68.12 -12.81 61.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.759 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.57 -4.47 21.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 -179.374 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.5 t -83.76 -40.09 15.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.916 -179.091 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 2.1 tm-20 -60.21 -49.61 89.93 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 -179.643 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.496 ' HG2' HD13 ' A' ' 46' ' ' ILE . 92.8 Cg_exo -43.72 -52.3 5.45 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 122.244 1.963 . . . . 0.0 112.083 179.229 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 24.5 mt -49.82 -37.14 29.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.394 -0.821 . . . . 0.0 112.197 -179.81 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 44.7 mm -61.0 -62.09 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.07 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.423 ' HG3' HD13 ' A' ' 61' ' ' LEU . 5.3 pttt -72.71 -6.58 45.5 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.934 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.705 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -89.03 -46.45 8.85 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -178.322 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.801 HD13 HD22 ' A' ' 92' ' ' LEU . 10.0 mt -60.76 -10.01 4.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.14 0.495 . . . . 0.0 110.377 -179.277 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -115.46 -14.98 11.54 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.146 -179.655 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -61.13 -31.59 71.3 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.124 0.488 . . . . 0.0 111.284 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.495 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 55.6 m-20 51.58 28.08 4.4 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.039 179.912 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 33.0 t -86.33 7.13 26.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.683 0.278 . . . . 0.0 111.27 179.903 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.59 -96.02 1.73 Allowed Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.296 -179.89 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -50.33 -43.63 54.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.128 0.49 . . . . 0.0 110.15 179.524 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.705 HG12 ' HG ' ' A' ' 61' ' ' LEU . 11.8 t -73.62 -46.23 48.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.864 -179.806 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.495 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 4.3 tmm_? -66.09 -64.03 0.95 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.549 -179.091 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.9 m -54.39 -27.1 34.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.608 179.827 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.6 -46.46 88.57 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.64 -0.79 . . . . 0.0 111.936 179.57 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' ' 77' ' ' LEU . . . -59.19 -56.09 26.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.581 0.229 . . . . 0.0 111.14 179.774 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -51.79 -27.0 10.87 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.07 0.462 . . . . 0.0 110.883 -179.562 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 34.8 ttt85 -80.31 -40.04 27.54 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.916 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.569 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 0.0 OUTLIER -67.08 -35.24 79.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.2 -178.966 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.474 HD12 ' O ' ' A' ' 73' ' ' ALA . 3.5 mp -56.68 -59.06 5.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.654 0.264 . . . . 0.0 111.092 -179.663 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.442 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 44.7 mt-10 -49.0 -27.15 2.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.804 179.817 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -70.73 -43.61 68.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.779 0.323 . . . . 0.0 111.501 -179.86 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.417 HG23 ' HG2' ' A' ' 50' ' ' GLN . 46.7 mt -70.06 -61.28 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.8 -179.12 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 53.14 89.52 0.01 OUTLIER Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.498 -179.716 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.448 ' H ' ' CG1' ' A' ' 85' ' ' VAL . . . 178.33 -173.45 45.88 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.607 -179.623 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.436 ' O ' ' HB2' ' A' ' 86' ' ' ARG . 4.9 tm-20 -72.24 -25.8 61.77 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.781 0.324 . . . . 0.0 111.181 -179.691 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.551 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -70.0 -50.72 38.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.984 0.421 . . . . 0.0 110.499 179.839 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.551 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 11.5 p -70.66 -25.69 26.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.434 179.132 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.593 ' NH2' ' HA ' ' A' ' 108' ' ' LEU . 1.1 mmp_? -47.12 -40.08 14.74 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.152 179.635 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.11 -30.92 71.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.443 -179.389 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.36 -55.42 33.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.81 -179.796 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.492 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.3 -25.86 65.35 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.198 -179.389 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 42.5 mt-10 -73.02 -34.37 66.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.97 0.414 . . . . 0.0 109.995 179.133 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -78.92 -24.9 43.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.427 179.111 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.801 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -87.63 -30.19 20.64 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.203 179.323 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.27 -29.97 67.96 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.147 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.07 -26.57 39.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.15 0.5 . . . . 0.0 109.692 179.339 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.8 p -107.59 21.24 17.75 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.608 178.524 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.617 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -46.48 108.53 0.27 Allowed Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.124 -0.943 . . . . 0.0 112.751 -179.431 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.441 ' O ' ' HB3' ' A' ' 100' ' ' ALA . 33.1 p -139.75 129.36 24.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.732 0.301 . . . . 0.0 110.727 -179.882 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 55.38 -145.02 32.11 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.858 -179.879 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -58.92 -30.46 67.86 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.715 0.293 . . . . 0.0 111.161 179.975 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.631 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -52.19 -42.59 63.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.852 -179.615 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.617 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 43.2 ttt180 -66.5 -55.6 14.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.676 0.274 . . . . 0.0 111.623 -179.535 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.2 tptp -46.05 -25.13 0.52 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.593 179.915 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.519 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 21.3 t -71.83 -58.43 5.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.912 -179.868 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.541 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -51.35 -60.88 2.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.819 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.522 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 21.8 t -56.58 -47.9 81.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -178.04 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -71.01 -35.01 71.89 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -179.52 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.514 ' OH ' HG11 ' A' ' 85' ' ' VAL . 14.1 t80 -64.11 -46.96 81.91 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.292 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.593 ' HA ' ' NH2' ' A' ' 86' ' ' ARG . 3.0 pp -55.34 -10.85 0.66 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.187 -178.882 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -89.11 6.96 37.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.52 0.2 . . . . 0.0 111.467 179.735 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.5 p -129.81 -66.54 0.79 Allowed 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.792 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.521 ' HB3' HH22 ' A' ' 86' ' ' ARG . 21.4 p80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 117.949 -1.024 . . . . 0.0 111.331 -179.266 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.4 mmt . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 120.908 0.385 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.02 117.49 19.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.229 179.968 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.3 t70 61.79 105.58 0.02 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.162 -179.932 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.435 ' HG2' ' N ' ' A' ' 5' ' ' ASN . 35.6 tt0 63.34 162.16 0.1 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.019 179.943 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.435 ' N ' ' HG2' ' A' ' 4' ' ' GLU . 64.2 t30 60.33 19.81 9.35 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.005 179.895 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -90.09 -70.86 0.65 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.85 179.968 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -6.18 29.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.366 -179.892 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 72.1 t -66.36 -24.93 34.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.263 -179.876 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.572 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 70.9 ttt180 -147.49 -5.66 0.48 Allowed 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.702 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 ttp180 -58.54 103.36 0.15 Allowed 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 177.643 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.9 t70 59.92 37.51 21.52 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -177.268 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.572 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 4.6 p -31.57 -51.38 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.635 -178.684 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.47 ' N ' HG13 ' A' ' 12' ' ' VAL . 18.1 t 62.06 -84.11 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.207 178.749 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.56 HG22 ' H ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -114.87 -161.17 0.76 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.656 179.812 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.56 ' H ' HG22 ' A' ' 14' ' ' THR . . . -95.21 -67.36 0.86 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.462 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.429 ' H ' ' HG ' ' A' ' 16' ' ' LEU . 1.9 pp -85.68 -12.81 50.31 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.007 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.415 ' N ' HD12 ' A' ' 16' ' ' LEU . 38.4 m -52.43 -34.16 47.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -179.06 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -140.81 -73.21 0.34 Allowed 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -179.167 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.541 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 14.3 ptm -48.46 -41.33 29.25 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.936 -178.621 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' A' ' 22' ' ' GLU . . . 50.7 -142.96 14.6 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.002 -179.652 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.1 t70 58.72 -80.2 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.648 0.261 . . . . 0.0 111.228 179.719 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 20' ' ' GLY . 0.8 OUTLIER -65.18 -17.44 64.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.988 0.423 . . . . 0.0 110.228 179.165 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.33 11.21 33.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.795 179.437 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.638 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.4 t80 -63.53 -45.28 91.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.444 179.95 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.446 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 24.2 mt-10 -63.37 -55.63 33.97 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.018 -179.653 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 9.4 Cg_endo -54.93 -16.1 11.2 Favored 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 121.74 1.626 . . . . 0.0 110.704 179.344 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.44 ' HB3' ' O ' ' A' ' 24' ' ' PHE . 1.0 OUTLIER -85.62 -34.31 21.43 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.461 -1.245 . . . . 0.0 108.881 178.842 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.491 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -77.32 -39.26 48.4 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.988 178.869 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -64.52 -37.14 86.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.214 -179.308 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 89.4 p -66.33 -14.56 62.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.945 -179.172 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.45 HD12 HD13 ' A' ' 28' ' ' LEU . 96.5 mt -60.15 -29.15 68.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.747 0.308 . . . . 0.0 111.154 -179.893 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.9 m -92.46 20.88 5.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.667 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.622 ' ND2' ' HB ' ' A' ' 38' ' ' ILE . 20.3 p-10 -75.3 150.56 38.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.851 179.995 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -67.05 -20.7 65.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.304 -179.807 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.568 ' HB2' ' ND2' ' A' ' 33' ' ' ASN . 7.5 m-20 -78.65 162.98 25.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.893 0.378 . . . . 0.0 111.052 -179.821 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -104.57 -44.43 4.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.829 -179.7 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.506 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 71.4 mtp85 -58.83 -58.36 8.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.663 -179.703 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.622 ' HB ' ' ND2' ' A' ' 33' ' ' ASN . 71.1 mt -50.05 -40.6 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.496 -179.582 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.467 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 43.1 ttp180 -64.41 -40.22 95.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.012 179.896 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -59.8 -58.86 12.0 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.285 179.952 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.66 -28.81 6.34 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.683 0.278 . . . . 0.0 111.173 179.675 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 39' ' ' ARG . . . -59.24 -56.37 23.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.721 179.702 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.61 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -64.24 -32.47 74.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.611 179.445 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.418 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 12.6 m95 -55.72 -32.02 62.98 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.959 179.926 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 50.9 mm -98.51 -24.52 4.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.61 179.507 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.61 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 5.6 mm -55.43 -44.59 76.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.654 -179.979 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.34 -22.75 59.15 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.796 -0.716 . . . . 0.0 113.214 -179.397 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -68.42 -40.55 81.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.81 0.305 . . . . 0.0 111.445 -179.797 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -97.15 112.22 24.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.718 0.294 . . . . 0.0 110.452 -179.929 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -77.22 58.14 1.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.767 179.762 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -102.7 172.69 6.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.935 -179.526 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -66.25 -45.47 80.44 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.876 -179.307 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -6.92 13.26 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.244 -0.183 . . . . 0.0 111.118 179.893 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.638 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -95.65 8.92 42.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.011 0.434 . . . . 0.0 111.042 -178.752 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 45.4 t -92.01 -59.11 3.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.558 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.415 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 27.3 tt0 -60.29 -49.64 89.63 Favored Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.495 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.47 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 58.4 Cg_exo -38.23 -44.88 2.06 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.709 2.273 . . . . 0.0 113.391 -179.088 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.609 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 8.0 mt -62.55 -54.05 45.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.321 -179.369 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.416 ' HA ' HD12 ' A' ' 62' ' ' LEU . 83.1 mt -50.53 -53.95 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.048 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.426 ' H ' ' HG3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -70.16 -24.27 63.13 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -177.956 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.586 ' HG ' HG12 ' A' ' 69' ' ' VAL . 3.7 tp -90.13 -20.0 23.63 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -178.716 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.668 HD13 HD11 ' A' ' 92' ' ' LEU . 6.3 mt -69.5 -12.59 61.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.937 0.399 . . . . 0.0 110.635 -179.916 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -112.68 1.73 15.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.978 -179.893 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -61.15 -30.35 70.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.165 0.507 . . . . 0.0 110.642 179.759 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.544 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 26.3 m-20 48.63 27.6 1.54 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.135 -0.939 . . . . 0.0 112.279 179.628 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.49 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 38.6 t -86.32 -15.06 41.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.765 0.316 . . . . 0.0 110.677 179.808 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 118.0 -109.94 1.9 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.504 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.506 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -59.15 -25.42 63.87 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.659 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.586 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.4 t -71.18 -32.29 47.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.645 178.61 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.544 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 52.8 ttp180 -78.7 -44.39 23.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.698 179.422 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.457 ' HA ' ' HZ ' ' A' ' 99' ' ' PHE . 28.9 t -67.09 -41.73 85.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.452 -179.83 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -51.18 -45.83 51.6 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.417 -179.79 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.609 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -71.75 -31.79 67.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.649 0.262 . . . . 0.0 111.048 179.68 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.636 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -60.17 -54.22 48.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.755 -179.224 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -61.88 -27.5 68.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.328 -179.645 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.443 ' HB2' HD22 ' A' ' 58' ' ' LEU . 50.4 m -58.87 -33.98 71.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.127 -179.831 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.611 HD11 HD11 ' A' ' 62' ' ' LEU . 9.1 mp -61.25 -60.64 3.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.89 0.376 . . . . 0.0 110.441 179.455 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -55.84 -24.95 39.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.295 178.909 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 76' ' ' SER . 42.6 mt-30 -70.73 -50.91 31.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.741 179.767 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.544 ' HB ' HG21 ' A' ' 85' ' ' VAL . 74.3 mt -66.03 -60.79 2.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.057 -179.984 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.64 127.46 0.02 OUTLIER Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.621 179.913 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 145.06 178.04 20.33 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.848 179.775 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.53 -34.35 78.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.846 0.355 . . . . 0.0 110.714 -179.99 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.51 ' CD ' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.72 -47.82 81.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.942 -179.881 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.544 HG21 ' HB ' ' A' ' 80' ' ' ILE . 33.1 t -70.56 -26.33 28.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.419 . . . . 0.0 110.648 179.654 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -58.61 -23.13 58.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.671 -179.895 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.9 -27.97 26.26 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.193 0.52 . . . . 0.0 109.771 179.434 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.98 -40.03 83.2 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.213 179.049 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.723 ' HE1' HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.2 -36.96 74.95 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.656 179.181 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -57.86 -32.72 67.94 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.623 178.876 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.8 tmtm? -64.56 -52.65 56.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.736 179.57 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.668 HD11 HD13 ' A' ' 62' ' ' LEU . 54.4 mt -61.83 -37.59 85.01 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.717 0.294 . . . . 0.0 110.712 -179.915 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.414 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -54.58 -31.03 56.06 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.179 0.514 . . . . 0.0 110.282 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -86.66 -21.93 26.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.013 179.425 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.2 p -118.01 38.15 3.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.122 -179.869 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.417 ' HA2' ' HB2' ' A' ' 101' ' ' ARG . . . -39.4 109.36 0.11 Allowed Glycine 0 C--N 1.334 0.448 0 CA-C-N 116.092 -0.504 . . . . 0.0 113.198 -179.78 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.1 t -151.88 138.55 18.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.834 0.349 . . . . 0.0 111.459 -179.888 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 55.09 -139.24 41.35 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.81 179.673 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.457 ' HZ ' ' HA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -94.76 -13.97 25.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.843 0.354 . . . . 0.0 110.6 -179.903 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.426 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -56.37 -35.02 67.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.829 179.824 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.417 ' HB2' ' HA2' ' A' ' 96' ' ' GLY . 11.0 tpt180 -61.74 -60.27 3.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.335 179.486 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -51.55 -32.62 28.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.022 179.277 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.426 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 22.7 t -64.57 -46.87 91.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.97 179.484 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.549 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -61.49 -51.92 66.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.977 -179.562 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 59.9 t -63.62 -60.9 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.273 -179.022 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -57.26 -30.08 64.36 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.744 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.03 -29.44 67.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.165 0.507 . . . . 0.0 110.039 -179.892 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.723 HD11 ' HE1' ' A' ' 89' ' ' MET . 98.0 mt -55.61 -25.29 37.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.011 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -51.26 -34.97 35.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.9 p -95.99 -57.0 2.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.329 179.994 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.959 179.993 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.4 ttp . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.866 0.365 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.54 112.76 14.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.979 179.926 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 57.87 85.26 0.09 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.83 -179.994 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -152.29 -63.6 0.17 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.612 -179.871 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -127.3 112.21 14.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.679 179.731 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -83.27 21.58 1.11 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.328 -179.814 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 17.9 p-90 -137.67 20.6 2.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 65.9 t -133.61 -32.44 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.816 179.742 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.526 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 8.6 ptm180 -96.47 -0.84 48.48 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.925 179.704 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.505 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 47.8 ttp180 -65.37 105.43 1.15 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.638 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.631 ' HB2' ' HG2' ' A' ' 18' ' ' ARG . 16.1 m-20 74.18 1.84 3.99 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.048 -179.404 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.526 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 2.6 p -59.67 142.6 14.91 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.191 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.599 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.49 ' HB2' ' O ' ' A' ' 12' ' ' VAL . 36.5 t 175.29 -40.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.834 -179.607 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.578 HG22 ' H ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -106.39 -162.31 0.85 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.184 179.433 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.578 ' H ' HG22 ' A' ' 14' ' ' THR . . . -93.28 -68.99 0.77 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.459 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -87.59 -15.77 36.43 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.51 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.3 t -53.09 -51.89 60.38 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.731 -179.108 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.631 ' HG2' ' HB2' ' A' ' 11' ' ' ASP . 17.9 tpp85 -172.87 118.92 0.34 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.848 0.356 . . . . 0.0 111.308 -179.86 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.402 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 95.2 mmm -133.33 -27.41 1.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.54 179.422 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 102.1 -54.12 0.77 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.767 179.661 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -141.24 -21.65 0.76 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.626 0.251 . . . . 0.0 111.499 -179.61 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 19' ' ' MET . 30.0 mm-40 -77.5 -28.23 52.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.438 -179.635 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.408 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -104.84 -7.81 19.15 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.54 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.472 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.3 t80 -60.93 -48.01 83.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.24 -179.917 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.411 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.49 -55.26 36.61 Favored Pre-proline 0 C--N 1.33 -0.249 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.238 179.775 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.411 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 52.5 Cg_exo -49.73 -26.34 13.12 Favored 'Trans proline' 0 C--N 1.357 1.019 0 C-N-CA 121.726 1.617 . . . . 0.0 110.458 179.022 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.52 HD11 HD12 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -76.93 -42.51 39.08 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.554 179.186 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 31' ' ' LEU . 11.7 tp -76.16 -17.15 59.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.04 178.937 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -74.53 -32.16 62.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.744 -179.79 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.482 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 71.6 m -66.41 -22.48 66.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.235 -179.779 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.684 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 93.6 mt -67.01 -9.54 40.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.81 0.338 . . . . 0.0 110.851 179.942 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.4 t -112.42 19.57 17.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.8 179.853 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.482 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 77.0 m-20 -89.82 147.53 23.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.212 -179.974 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -66.23 -23.05 66.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.772 179.835 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -78.01 149.18 34.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.935 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.6 p90 -93.28 -38.45 11.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.861 180.0 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.433 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 72.9 mtt-85 -60.4 -54.08 49.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.314 179.693 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.3 mm -54.57 -40.88 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.589 -179.359 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.684 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 39.7 ttm180 -65.46 -27.34 68.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.381 -179.774 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.533 ' HA2' HG13 ' A' ' 69' ' ' VAL . . . -64.4 -63.0 4.61 Favored Glycine 0 N--CA 1.453 -0.183 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.546 -179.782 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.57 -22.69 0.3 Allowed 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 179.995 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.431 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.5 -57.31 13.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.727 0.298 . . . . 0.0 110.924 179.85 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.97 -24.89 66.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.922 0.392 . . . . 0.0 110.805 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -61.85 -39.2 91.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.394 -179.925 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 33.5 mm -100.93 -21.62 5.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-O 120.831 0.348 . . . . 0.0 111.8 -179.521 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.52 HD12 HD11 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -54.52 -38.01 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.265 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.3 -20.6 79.6 Favored Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 120.507 -0.854 . . . . 0.0 113.205 -178.979 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.8 -0.8 9.77 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.383 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.432 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 91.0 m-85 -103.68 -34.01 8.76 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.716 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 49' ' ' PHE . 53.7 mt-30 67.31 57.27 0.59 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.245 0.545 . . . . 0.0 110.976 179.9 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -128.26 164.72 21.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.041 -179.803 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -65.48 -32.48 74.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.149 0.5 . . . . 0.0 110.098 179.355 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -69.3 -9.65 54.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.806 179.81 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.494 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -104.68 2.16 30.18 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.997 -179.378 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.2 t -86.57 -47.72 16.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.444 -179.416 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.492 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 23.2 tt0 -60.35 -47.76 95.67 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.788 -179.838 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 98.7 Cg_exo -43.68 -42.7 11.56 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.589 2.193 . . . . 0.0 113.002 -179.622 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.618 HD13 HD12 ' A' ' 77' ' ' LEU . 11.3 mt -64.66 -39.79 94.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.057 -179.874 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.423 HD11 ' HB1' ' A' ' 88' ' ' ALA . 47.6 mm -54.57 -57.66 5.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.981 -179.564 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.2 tmmm? -70.07 -28.46 65.45 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -178.353 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.538 ' HB3' ' HB2' ' A' ' 73' ' ' ALA . 4.7 tp -89.62 -21.39 22.83 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -177.521 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.749 HD13 HD22 ' A' ' 92' ' ' LEU . 22.4 mt -67.19 -20.81 65.77 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.584 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -92.41 -11.38 35.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.676 178.764 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.412 ' OD2' ' HB ' ' A' ' 69' ' ' VAL . 11.9 t70 -52.27 145.76 10.38 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.883 -178.523 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -118.29 27.0 9.23 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.021 -179.836 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.537 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 27.0 t -86.44 -36.38 19.13 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.898 -179.903 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 126.76 -96.72 0.47 Allowed Glycine 0 N--CA 1.452 -0.263 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.921 -179.603 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.433 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -61.48 -26.97 68.25 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.104 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.537 ' HB ' ' HB3' ' A' ' 66' ' ' SER . 32.2 t -67.95 -36.48 75.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.106 178.999 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -74.04 -55.3 6.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.358 179.549 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 36.8 t -59.07 -25.76 64.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.929 179.833 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.59 -45.6 89.87 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.367 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.538 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . . . -70.04 -30.28 67.52 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.863 0.363 . . . . 0.0 110.674 179.664 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 77' ' ' LEU . . . -61.75 -53.04 61.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.897 -179.439 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -66.22 -22.53 66.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.682 -179.152 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.446 ' O ' HG13 ' A' ' 80' ' ' ILE . 40.4 t -58.59 -32.84 69.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.488 -179.645 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.618 HD12 HD13 ' A' ' 58' ' ' LEU . 7.2 mp -55.38 -62.27 1.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.503 -179.82 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.461 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 42.2 mt-10 -55.42 -32.84 63.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.255 179.563 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -70.7 -27.17 63.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.165 -179.961 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 76' ' ' SER . 96.7 mt -83.16 -59.02 3.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.769 -179.284 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.645 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . -179.56 -116.37 0.51 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.034 -1.079 . . . . 0.0 113.411 -179.516 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.454 ' O ' ' HB2' ' A' ' 86' ' ' ARG . . . -157.91 -71.02 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 121.208 -0.52 . . . . 0.0 112.022 -179.972 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.419 ' HG3' ' NH2' ' A' ' 86' ' ' ARG . 43.1 tt0 -72.24 -21.83 61.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.864 0.364 . . . . 0.0 111.244 -179.922 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.645 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.0 OUTLIER -75.58 -56.97 4.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.206 -178.912 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' ' SD ' ' A' ' 89' ' ' MET . 0.4 OUTLIER -68.3 -29.94 46.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.413 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 33.1 ttp180 -41.83 -35.05 0.74 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.921 -179.401 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.83 -49.37 75.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.872 0.368 . . . . 0.0 110.764 -179.877 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.423 ' HB1' HD11 ' A' ' 59' ' ' ILE . . . -69.44 -34.54 74.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.859 179.588 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.617 ' HG3' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -60.64 -48.45 81.71 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.18 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 46.7 mt-10 -56.13 -35.6 67.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.425 178.051 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -76.54 -25.86 54.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.979 179.753 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.813 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.9 OUTLIER -84.46 -24.98 29.26 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.774 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.71 -28.05 68.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.894 178.904 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -80.24 -25.66 39.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.258 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.8 p -109.42 17.18 21.72 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.433 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.534 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -54.49 116.82 6.89 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 114.7 -1.136 . . . . 0.0 113.311 -179.079 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.3 t -142.41 132.14 24.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.861 0.362 . . . . 0.0 110.958 179.258 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.26 -124.72 35.51 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.559 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.574 ' O ' HG23 ' A' ' 103' ' ' VAL . 68.5 t80 -79.91 -29.99 39.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.881 0.372 . . . . 0.0 110.37 179.583 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.587 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.79 -36.11 35.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.483 179.837 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.534 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 23.4 ttt180 -70.4 -61.11 1.9 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.655 -179.535 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -47.8 -22.27 0.52 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.238 -179.492 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 99' ' ' PHE . 39.2 t -63.53 -60.27 3.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.792 -179.916 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.813 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.99 -62.35 1.88 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.224 0.535 . . . . 0.0 112.431 -179.203 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.537 HG13 ' H ' ' A' ' 106' ' ' ASN . 3.1 p -52.68 -56.81 5.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.227 -0.897 . . . . 0.0 113.267 -178.294 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.537 ' H ' HG13 ' A' ' 105' ' ' VAL . 55.1 t30 -59.97 -35.38 74.87 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -178.813 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.582 ' HD2' ' HG2' ' A' ' 89' ' ' MET . 30.2 t80 -61.8 -25.48 67.52 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.98 0.419 . . . . 0.0 110.688 -179.323 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 99.3 mt -58.95 -13.18 5.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.592 179.694 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -64.98 -7.24 10.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.604 179.84 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 73.0 p -93.12 -49.82 5.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.648 179.64 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.884 179.486 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.792 0.329 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 56.72 -91.42 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.482 179.968 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.408 ' H ' ' H ' ' A' ' 4' ' ' GLU . 14.5 t70 -166.3 -17.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.66 -179.975 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.408 ' H ' ' H ' ' A' ' 3' ' ' ASP . 12.4 pt-20 -57.34 -27.76 62.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.967 179.967 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.506 ' C ' ' H ' ' A' ' 7' ' ' TRP . 26.9 t-20 -82.37 -91.98 0.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.964 -179.864 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt 67.39 -15.57 0.17 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.553 -179.89 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.506 ' H ' ' C ' ' A' ' 5' ' ' ASN . 95.1 m95 -113.54 -143.27 0.39 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.452 -179.992 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.423 ' C ' ' H ' ' A' ' 10' ' ' ARG . 0.4 OUTLIER 67.75 144.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 120.855 0.359 . . . . 0.0 111.26 -179.996 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.575 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 33.1 ttp180 72.46 -26.12 0.18 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.573 179.905 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.486 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 57.0 mtp180 -67.46 119.95 13.12 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 177.763 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.486 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 23.8 m-20 70.38 17.36 6.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.069 0.461 . . . . 0.0 110.104 -178.688 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.575 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 9.9 p -55.18 164.71 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.215 -179.766 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.46 ' N ' HG22 ' A' ' 12' ' ' VAL . 30.3 t 69.85 -1.88 2.2 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.627 179.187 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 82.4 p -142.28 11.73 1.95 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.006 0.431 . . . . 0.0 110.747 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' A' ' 23' ' ' ALA . . . -94.91 -10.02 32.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.23 -179.768 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.607 ' HA ' ' HB1' ' A' ' 23' ' ' ALA . 73.2 mt -54.44 -16.18 2.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.34 -179.256 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 67.8 m -48.5 -52.29 23.12 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.581 0.229 . . . . 0.0 110.986 -179.826 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.409 ' H ' ' H ' ' A' ' 19' ' ' MET . 0.0 OUTLIER 167.82 21.3 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.464 179.607 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 15' ' ' ALA . 12.5 mtt -61.25 -20.82 63.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.438 -179.468 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.87 -123.67 7.85 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.661 -0.781 . . . . 0.0 113.184 179.218 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -57.81 -39.0 76.55 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.752 0.31 . . . . 0.0 111.087 -179.694 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -60.9 -15.7 33.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.614 179.769 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.607 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -105.01 -15.35 15.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.711 -179.51 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.474 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.9 t80 -57.99 -52.38 65.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.717 -179.028 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.46 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 2.8 mt-10 -62.63 -57.17 23.63 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.674 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 13.9 Cg_endo -57.41 -12.03 9.82 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 122.112 1.875 . . . . 0.0 111.892 -179.729 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.636 HD21 ' HA ' ' A' ' 46' ' ' ILE . 1.9 tp -84.89 -44.3 13.31 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.96 179.899 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.438 ' H ' ' HG ' ' A' ' 28' ' ' LEU . 3.1 pp -84.34 -16.34 43.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.693 178.733 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -71.76 -31.38 66.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.086 179.566 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 t -66.35 -19.09 65.71 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.122 179.986 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 57' ' ' PRO . 91.5 mt -57.14 -16.77 8.49 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.856 0.36 . . . . 0.0 111.03 -179.926 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 74.6 m -94.7 23.46 5.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.224 -179.94 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.553 HD21 ' HB2' ' A' ' 39' ' ' ARG . 2.2 p30 -85.37 147.48 26.49 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.819 0.342 . . . . 0.0 110.583 -179.728 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -66.95 -25.89 66.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.143 -178.885 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -82.72 163.54 21.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.35 . . . . 0.0 111.082 -179.798 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.7 p-90 -101.75 -35.68 8.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.141 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.512 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 67.9 ttt180 -62.78 -29.74 70.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.35 -179.78 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.1 mt -76.5 -48.98 25.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.785 0.326 . . . . 0.0 111.256 -179.793 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.553 ' HB2' HD21 ' A' ' 33' ' ' ASN . 31.5 ttm180 -55.69 -27.83 52.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.254 -179.715 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.689 ' HA2' HD21 ' A' ' 61' ' ' LEU . . . -67.68 -55.68 13.78 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.744 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.13 -29.67 14.18 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.774 0.321 . . . . 0.0 111.245 179.793 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.564 ' O ' HD11 ' A' ' 27' ' ' LEU . . . -57.73 -54.37 47.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.851 179.797 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.542 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -68.43 -29.3 67.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.008 179.943 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.419 ' CD1' ' HA3' ' A' ' 72' ' ' GLY . 6.6 m95 -59.94 -38.04 81.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.626 -179.899 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.1 mm -98.87 -19.49 5.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.837 0.351 . . . . 0.0 111.718 -179.776 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.672 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.2 OUTLIER -52.74 -44.03 46.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.009 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.97 -13.51 83.09 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.69 -0.767 . . . . 0.0 113.701 -178.748 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -70.77 -3.5 19.11 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 -179.37 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -99.59 -30.4 12.15 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.27 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.467 ' HG3' HG13 ' A' ' 80' ' ' ILE . 1.1 tt0 71.0 51.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.135 0.493 . . . . 0.0 111.029 179.284 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -127.45 155.71 43.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.13 -179.97 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.576 ' O ' HG22 ' A' ' 55' ' ' VAL . 0.4 OUTLIER -63.51 -30.3 71.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.664 179.734 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -69.22 -10.11 56.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.96 179.738 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.672 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -94.54 11.96 29.08 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -179.032 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.576 HG22 ' O ' ' A' ' 52' ' ' GLU . 23.0 m -91.68 -42.15 13.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.359 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.592 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 6.5 tp10 -60.34 -50.31 86.42 Favored Pre-proline 0 C--N 1.327 -0.378 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.667 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.676 ' HB3' HD11 ' A' ' 31' ' ' LEU . 52.3 Cg_exo -53.67 -23.54 26.46 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.262 1.975 . . . . 0.0 112.88 -179.271 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.546 HD22 ' HA ' ' A' ' 73' ' ' ALA . 57.2 mt -84.99 -40.69 16.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.09 -179.58 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.607 ' HA ' HD12 ' A' ' 62' ' ' LEU . 49.9 mm -58.88 -43.33 88.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.837 -179.536 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -70.03 -26.65 64.14 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -178.821 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.689 HD21 ' HA2' ' A' ' 40' ' ' GLY . 5.2 tp -88.97 -29.07 19.81 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -178.21 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.639 HD13 HD22 ' A' ' 92' ' ' LEU . 15.5 mt -58.66 -19.16 36.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.975 0.417 . . . . 0.0 110.565 179.153 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -111.93 -0.93 15.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.162 -179.882 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.541 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 6.2 t70 -61.25 -36.95 81.38 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.408 0.623 . . . . 0.0 110.482 -179.849 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.459 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 10.8 m-20 56.7 25.67 10.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.522 179.296 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.456 ' HB2' ' OD1' ' A' ' 64' ' ' ASP . 0.3 OUTLIER -80.5 -27.75 37.66 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 121.057 0.456 . . . . 0.0 109.959 179.262 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 131.9 -103.64 0.54 Allowed Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.554 179.709 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.512 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -58.34 -24.31 59.37 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 117.041 0.42 . . . . 0.0 109.949 179.855 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.408 HG12 ' HA3' ' A' ' 40' ' ' GLY . 4.0 m -70.24 -40.19 77.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 121.231 0.539 . . . . 0.0 109.774 178.495 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.459 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 50.5 ttp180 -71.12 -44.96 64.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.542 179.921 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.4 p -67.16 -35.08 78.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.87 179.469 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.492 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -62.22 -55.8 25.74 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.647 -179.736 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.546 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -58.08 -39.5 78.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.899 0.381 . . . . 0.0 110.714 179.749 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.458 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.89 -46.07 90.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.512 -179.76 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 0.2 OUTLIER -70.85 -32.64 69.73 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.423 -179.041 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' A' ' 79' ' ' GLN . 46.5 m -61.79 -34.44 75.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.806 0.336 . . . . 0.0 110.996 -179.791 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.6 HD11 HD11 ' A' ' 62' ' ' LEU . 66.5 mt -59.64 -60.65 3.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.977 0.418 . . . . 0.0 110.62 179.576 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -65.34 -18.18 65.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.641 179.456 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.437 ' HB3' ' O ' ' A' ' 76' ' ' SER . 48.4 tt0 -56.88 -39.93 75.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.91 -179.897 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.506 HG21 ' HD2' ' A' ' 84' ' ' ARG . 3.2 mp -80.43 -56.77 5.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.928 179.584 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.454 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 71.03 58.56 5.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.339 -179.781 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -135.13 179.84 17.27 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.304 179.786 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.08 -22.1 64.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.809 0.338 . . . . 0.0 110.836 179.957 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.513 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -76.9 -31.42 56.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.786 -179.271 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.513 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 38.2 t -70.31 -33.76 55.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.915 0.388 . . . . 0.0 110.195 179.412 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.8 ttp180 -56.26 -21.93 26.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.062 179.961 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.33 -33.86 37.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.688 179.928 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.18 -31.03 68.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.971 179.805 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.509 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 10.0 mmm -72.21 -50.03 30.67 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.306 179.866 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.43 -35.62 65.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.168 179.4 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.463 ' O ' ' HD3' ' A' ' 91' ' ' LYS . 11.7 tmtt? -70.27 -31.73 69.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.866 179.853 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.639 HD22 HD13 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -85.99 -28.62 24.09 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 179.845 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.46 -28.91 60.94 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.849 178.83 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -80.18 -27.76 38.86 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.077 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.3 p -109.35 25.96 11.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.68 178.827 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.488 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -49.75 113.06 1.64 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.45 -178.983 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 58.2 m -141.1 130.4 23.63 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.181 -0.304 . . . . 0.0 110.181 179.435 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.26 -130.27 12.23 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.063 -179.381 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -95.82 -15.82 22.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.732 0.301 . . . . 0.0 110.839 179.939 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.464 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.71 -42.89 62.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.437 -179.749 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.488 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 60.5 ttt180 -59.29 -60.7 3.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.01 -179.969 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.6 tttp -49.91 -24.33 2.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.25 0.548 . . . . 0.0 110.333 179.621 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.46 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.1 t -79.82 -48.56 20.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.388 179.943 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.588 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.62 -53.08 62.35 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.258 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 28.3 t -64.91 -58.99 4.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.917 -178.084 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -55.59 -38.61 69.63 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.519 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.509 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 36.7 t80 -63.34 -25.22 68.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.829 0.347 . . . . 0.0 111.231 -178.805 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 94.0 mt -56.37 -20.13 17.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.543 -179.785 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -78.56 6.23 9.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.603 -179.416 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.0 p -138.9 -53.46 0.58 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.469 179.917 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.8 p-80 . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.43 -179.788 . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptt? . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.802 0.334 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.35 134.83 41.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.94 179.944 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.6 t70 62.95 12.97 6.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.896 -179.888 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -128.07 -15.45 4.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.918 179.753 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -70.61 111.21 5.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.819 179.907 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -171.64 -49.59 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.01 -179.916 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -86.86 32.84 0.66 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.986 -179.943 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 53.1 t -58.86 -46.61 91.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.658 -179.694 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.482 ' HA ' HG23 ' A' ' 12' ' ' VAL . 14.9 ptm180 -128.3 2.26 5.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.604 0.24 . . . . 0.0 111.487 -179.662 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.463 ' NE ' ' HA ' ' A' ' 10' ' ' ARG . 5.2 mmp_? -64.37 105.6 0.96 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.274 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.448 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 16.0 t70 77.97 -34.29 0.18 Allowed 'General case' 0 N--CA 1.465 0.291 0 O-C-N 123.694 0.621 . . . . 0.0 110.924 -179.514 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.482 HG23 ' HA ' ' A' ' 9' ' ' ARG . 1.5 m -85.78 96.68 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-O 120.975 0.417 . . . . 0.0 110.839 179.58 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 49.7 m -82.98 -167.94 1.87 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.477 -179.361 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.549 HG22 ' H ' ' A' ' 15' ' ' ALA . 2.6 m 63.32 169.23 0.15 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.839 -179.834 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.549 ' H ' HG22 ' A' ' 14' ' ' THR . . . -95.51 -68.47 0.8 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.838 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mt -86.25 -22.78 26.67 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -178.48 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.535 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 28.3 t -56.18 -48.41 76.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.525 0.202 . . . . 0.0 111.352 -179.28 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.515 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 3.2 tpm_? -164.95 97.56 0.74 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.828 0.347 . . . . 0.0 111.299 -179.907 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.553 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 4.4 mmt -133.3 -20.81 2.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.834 179.575 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.74 -116.28 4.95 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.39 -179.898 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -83.35 -17.89 40.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.731 0.301 . . . . 0.0 110.987 -179.984 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 19' ' ' MET . 9.6 tp10 -71.3 -30.13 65.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.857 179.817 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.654 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -100.77 3.32 42.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.115 -179.863 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.513 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 1.9 t80 -56.49 -64.82 0.74 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.725 179.798 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.522 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.36 -50.8 72.4 Favored Pre-proline 0 C--N 1.329 -0.314 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 179.563 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.654 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 53.9 Cg_exo -45.81 -25.06 2.36 Favored 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 121.933 1.756 . . . . 0.0 110.826 179.706 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.689 HD21 HG13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -82.62 -47.08 12.49 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.364 178.921 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 28' ' ' LEU . 1.0 OUTLIER -58.26 -39.33 78.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.13 178.443 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -59.81 -29.07 67.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.393 -179.21 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.9 m -64.98 -22.43 67.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.581 -179.356 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.466 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 68.0 mt -69.55 -11.74 61.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.054 -179.844 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.3 t -109.65 13.09 23.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.705 179.889 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -78.55 135.68 37.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.031 -179.862 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -58.22 -26.84 63.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.207 -179.986 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -84.84 130.85 34.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.046 179.993 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -84.04 -27.74 28.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.729 179.809 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.8 mtp180 -62.51 -42.11 99.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.585 179.537 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.4 mt -79.89 -31.57 13.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.768 179.952 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.466 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 35.6 ttm180 -65.53 -36.21 83.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.626 179.732 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -57.34 -48.81 77.67 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.072 179.818 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.31 -35.86 68.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.7 0.285 . . . . 0.0 110.944 179.611 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.417 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.7 -53.2 59.5 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.424 179.514 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.37 90.8 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.454 179.126 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.677 ' HA ' ' NH1' ' A' ' 75' ' ' ARG . 7.9 m95 -63.62 -28.55 70.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.013 -179.233 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.7 mm -98.95 -24.07 4.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.921 0.391 . . . . 0.0 111.108 179.839 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.689 HG13 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -60.84 -30.97 48.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.847 -179.315 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.514 ' HA3' HH21 ' A' ' 75' ' ' ARG . . . -61.26 -28.99 70.12 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.86 -179.744 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -59.84 -26.2 65.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.85 0.357 . . . . 0.0 110.399 179.857 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.404 ' C ' ' H ' ' A' ' 51' ' ' ASP . 47.0 m-85 -94.94 111.72 23.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.486 179.847 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -80.27 36.72 0.37 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.461 179.831 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.473 ' O ' HG23 ' A' ' 55' ' ' VAL . 20.6 m-20 -102.34 158.18 16.38 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.789 -179.698 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.72 -33.75 75.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.798 -179.189 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.513 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 18.8 ttm180 -65.84 -13.44 59.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.951 0.405 . . . . 0.0 110.558 -180.0 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.427 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -105.15 -3.03 23.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.353 179.97 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 51' ' ' ASP . 93.2 t -91.21 -34.26 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.277 -179.907 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.465 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 20.9 tt0 -60.36 -44.85 97.06 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 116.272 -0.422 . . . . 0.0 112.077 -179.864 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.554 ' O ' HD13 ' A' ' 61' ' ' LEU . 94.6 Cg_exo -45.53 -53.0 6.0 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.437 2.091 . . . . 0.0 113.578 -179.548 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.756 HD12 ' HA ' ' A' ' 73' ' ' ALA . 0.1 OUTLIER -54.27 -30.32 50.2 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.965 0.358 . . . . 0.0 111.965 -178.864 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 43.5 mm -55.12 -59.06 2.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.736 0.303 . . . . 0.0 111.584 -179.557 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -70.06 -37.16 75.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.802 -179.518 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.714 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -52.54 -55.55 21.38 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.91 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.666 HD13 HD22 ' A' ' 92' ' ' LEU . 9.3 mt -51.76 -13.92 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.609 -179.729 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -113.11 -19.15 11.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.024 179.857 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.443 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 7.9 t0 -61.18 -34.56 75.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.005 0.431 . . . . 0.0 111.422 -179.773 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.658 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 14.4 m-20 54.85 29.64 12.36 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.317 -179.707 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.507 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.0 t -83.18 0.29 46.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.383 -179.973 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.61 -78.19 1.67 Allowed Glycine 0 C--O 1.228 -0.237 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.199 -179.665 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.95 -45.2 94.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.158 0.504 . . . . 0.0 109.818 179.32 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.714 HG12 ' HG ' ' A' ' 61' ' ' LEU . 10.7 t -73.63 -46.68 47.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.514 -179.839 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.658 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 14.0 ttp180 -63.35 -59.23 4.97 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -179.357 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.4 t -50.91 -32.78 21.74 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.98 -179.353 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.56 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -54.24 -47.66 67.11 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.817 179.479 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.756 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -51.04 -32.39 21.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.656 0.265 . . . . 0.0 111.558 179.9 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.94 -60.98 2.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.686 -179.226 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.677 ' NH1' ' HA ' ' A' ' 44' ' ' TRP . 0.2 OUTLIER -61.42 -27.92 68.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.711 -179.397 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 39.3 t -62.15 -52.67 62.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.726 0.298 . . . . 0.0 111.51 -179.663 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.514 ' HA ' HG11 ' A' ' 85' ' ' VAL . 8.3 mp -55.72 -60.72 3.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.645 -179.83 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -55.57 -24.65 33.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.968 0.413 . . . . 0.0 110.566 179.644 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.469 HE22 ' HE ' ' A' ' 75' ' ' ARG . 3.1 mt-30 -70.87 -48.25 54.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.132 179.806 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 79.5 mt -71.97 -60.71 2.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.4 -179.494 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.446 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 67.75 121.33 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.729 -179.943 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.513 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 146.11 179.72 22.51 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.762 179.935 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -66.06 -31.72 72.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.919 0.39 . . . . 0.0 110.603 -179.97 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.557 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.59 -52.31 64.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.069 -179.744 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.557 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.1 OUTLIER -70.37 -22.88 24.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.981 0.419 . . . . 0.0 110.518 179.693 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -58.63 -22.15 55.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.382 179.503 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 90' ' ' GLU . . . -76.69 -32.26 57.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.317 179.602 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.23 -48.8 77.91 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.982 179.156 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.589 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -72.12 -24.43 61.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.556 179.115 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.496 ' N ' ' HE2' ' A' ' 89' ' ' MET . 19.8 mm-40 -66.74 -35.05 79.19 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.999 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -81.49 -28.84 33.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.815 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.767 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.5 OUTLIER -85.67 -35.03 21.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.605 0.24 . . . . 0.0 110.864 -179.288 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -55.55 -28.47 55.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.963 0.411 . . . . 0.0 110.496 179.104 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.22 -26.17 39.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.386 179.934 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 50.0 p -117.6 30.96 6.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.615 179.2 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.421 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -53.35 121.55 17.45 Favored Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 115.186 -0.915 . . . . 0.0 113.539 -178.999 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.429 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 29.4 m -154.13 130.27 10.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.833 0.349 . . . . 0.0 110.682 179.124 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.04 -158.45 25.35 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.904 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -55.35 -33.18 63.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.608 0.242 . . . . 0.0 111.247 179.972 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.716 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -48.55 -48.05 38.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.316 -179.913 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.429 ' HB2' ' N ' ' A' ' 97' ' ' THR . 72.0 ttt180 -60.23 -58.35 8.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.994 -179.618 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -45.89 -24.91 0.45 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.381 -179.08 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 40.3 t -68.37 -52.98 31.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.367 179.763 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.767 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -53.41 -63.03 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.499 0.666 . . . . 0.0 112.375 -179.374 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.472 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 32.8 t -52.18 -62.83 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.779 -1.1 . . . . 0.0 113.412 -178.355 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -55.45 -34.22 64.29 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -178.236 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -59.42 -28.53 67.02 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-O 120.987 0.422 . . . . 0.0 111.145 -179.031 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 15.2 mt -62.13 -14.99 42.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.61 179.949 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -79.36 5.81 11.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.863 -179.411 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 35.5 p -146.63 -34.19 0.29 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.734 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.413 ' OXT' ' HA2' ' A' ' 81' ' ' GLY . 40.8 m80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.293 -179.125 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.9 mtp . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.667 0.27 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.67 -65.13 0.57 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.309 179.982 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -116.93 -16.82 10.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 0.0 110.696 179.689 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -86.46 118.68 26.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.891 179.959 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 63.71 162.67 0.11 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.22 179.9 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -168.1 -28.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.919 -179.968 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -128.98 82.65 2.1 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.043 0.449 . . . . 0.0 110.789 179.667 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.62 ' HA ' ' HG3' ' A' ' 22' ' ' GLU . 82.0 t -141.88 -71.72 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.718 179.921 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.558 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 14.0 ptm180 -99.93 -15.01 18.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.787 -179.899 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 9.8 mpt_? -67.19 114.38 5.88 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 178.256 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.4 t70 73.81 12.02 4.47 Favored 'General case' 0 C--O 1.232 0.141 0 O-C-N 123.436 0.46 . . . . 0.0 110.982 -179.596 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.558 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 9.8 p -56.78 169.13 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.887 179.911 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.545 ' H ' HG22 ' A' ' 12' ' ' VAL . 26.7 t 68.15 8.88 6.84 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 120.914 0.388 . . . . 0.0 110.916 179.751 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 29.6 m -146.82 -23.12 0.41 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.407 179.678 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.93 -2.89 22.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.353 179.981 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.417 ' H ' ' HG ' ' A' ' 16' ' ' LEU . 2.8 pp -66.43 -14.07 61.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.794 0.33 . . . . 0.0 110.975 179.946 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.7 t -79.32 -4.67 51.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.571 179.601 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -148.94 -64.64 0.23 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.546 -179.963 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 24.5 ttm -52.92 -43.66 66.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.022 179.948 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 40.85 39.9 2.07 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.311 -0.471 . . . . 0.0 113.492 179.473 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -141.66 -72.29 0.33 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.857 0.361 . . . . 0.0 110.694 179.903 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.62 ' HG3' ' HA ' ' A' ' 8' ' ' VAL . 11.6 mm-40 -67.86 -16.36 64.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.06 179.562 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.88 9.97 32.61 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.757 179.188 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.513 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 15.0 t80 -63.3 -37.15 86.15 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.151 0.501 . . . . 0.0 110.425 179.86 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.412 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 1.1 mp0 -63.28 -57.68 19.36 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.998 179.759 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.5 Cg_endo -56.08 -14.5 11.7 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 121.484 1.456 . . . . 0.0 110.13 179.235 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.426 ' HB3' ' O ' ' A' ' 24' ' ' PHE . 0.7 OUTLIER -86.86 -37.45 17.7 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.285 -1.325 . . . . 0.0 109.089 178.451 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 28' ' ' LEU . 3.4 tm? -75.96 -31.41 59.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.824 179.459 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -71.31 -15.47 62.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.416 179.917 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.417 ' HB3' HG22 ' A' ' 38' ' ' ILE . 65.2 m -66.45 -51.5 56.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.14 -179.125 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.504 HD21 HD22 ' A' ' 28' ' ' LEU . 2.4 pp -60.45 -7.71 2.26 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.7 0.286 . . . . 0.0 111.527 -179.329 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.9 m -88.93 19.71 3.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.85 0.357 . . . . 0.0 110.449 179.529 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -105.08 150.57 24.89 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.094 179.951 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -67.38 -12.37 60.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.678 179.526 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -76.0 153.57 36.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.651 -179.929 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.3 m95 -102.78 -32.81 9.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.082 -179.7 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.527 ' HG3' HG13 ' A' ' 38' ' ' ILE . 34.0 ptt180 -62.0 -39.49 92.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.938 179.981 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.527 HG13 ' HG3' ' A' ' 37' ' ' ARG . 40.9 mt -82.22 -32.32 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.999 0.428 . . . . 0.0 110.517 179.475 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -38.83 78.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.302 -179.988 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.53 -53.97 7.07 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.879 -179.462 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.41 -39.14 46.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.709 0.29 . . . . 0.0 111.76 -179.912 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.407 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -64.4 -33.45 75.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.24 -179.759 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.441 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -85.44 -28.88 24.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.383 -179.88 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.0 m95 -69.53 -31.54 69.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.267 -178.778 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.8 mt -99.29 -19.43 5.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.981 0.42 . . . . 0.0 111.199 -179.246 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.554 HG12 ' HA ' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -51.17 -27.53 6.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.826 -179.346 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -93.11 -22.67 26.9 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.111 -179.084 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -69.84 -12.07 61.34 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 -179.589 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.419 ' HB2' ' HE2' ' A' ' 24' ' ' PHE . 22.2 m-85 -101.94 -35.66 8.91 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.747 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.436 ' HG2' HG23 ' A' ' 80' ' ' ILE . 1.4 tt0 69.61 72.06 0.24 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 0.0 110.843 179.622 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -126.68 170.53 12.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.277 179.876 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.553 ' O ' HG22 ' A' ' 55' ' ' VAL . 0.5 OUTLIER -66.43 -38.84 88.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.623 -179.292 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.458 ' HB2' ' HE1' ' A' ' 24' ' ' PHE . 0.2 OUTLIER -69.2 -9.98 55.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -179.614 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.554 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -88.59 10.61 19.88 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.902 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.553 HG22 ' O ' ' A' ' 52' ' ' GLU . 27.4 m -92.47 -49.21 13.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.851 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.525 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -60.42 -51.95 76.41 Favored Pre-proline 0 CA--C 1.533 0.297 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.963 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.525 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 71.8 Cg_exo -41.56 -53.06 3.43 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 122.404 2.069 . . . . 0.0 112.536 -179.898 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.445 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 8.4 mt -52.1 -47.87 65.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.693 -179.399 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 51.2 mt -54.76 -56.91 8.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.208 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.442 ' HB2' ' NZ ' ' A' ' 60' ' ' LYS . 0.1 OUTLIER -69.68 -16.2 63.31 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -178.876 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.885 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.6 OUTLIER -88.85 -46.26 9.08 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.303 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.845 HD13 HD11 ' A' ' 92' ' ' LEU . 7.1 mt -59.61 -15.06 16.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.176 0.512 . . . . 0.0 110.208 -179.306 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -112.31 -11.71 13.67 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.281 179.322 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.551 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 7.1 t70 -61.32 -32.12 71.98 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.772 -179.758 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.653 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 1.3 m-20 57.09 27.18 12.99 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.583 -179.82 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.522 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.5 t -85.55 -3.35 58.84 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.161 -179.941 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.83 -73.34 2.57 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.503 179.914 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -70.32 -43.53 70.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.022 0.439 . . . . 0.0 110.029 179.536 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.885 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.7 t -73.83 -33.49 37.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.386 179.949 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.701 HH21 ' H ' ' A' ' 100' ' ' ALA . 62.5 ttt180 -77.49 -53.58 7.45 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.128 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.484 ' O ' ' HG3' ' A' ' 75' ' ' ARG . 90.8 p -50.8 -55.45 16.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.572 -178.949 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -45.35 -32.3 3.71 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 121.202 -0.523 . . . . 0.0 113.071 -179.553 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.445 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -69.47 -48.83 59.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.646 0.26 . . . . 0.0 111.179 179.94 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.65 -35.77 66.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.283 -179.616 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 71' ' ' SER . 8.8 mtp85 -74.27 -34.04 63.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.319 179.874 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.0 t -61.44 -37.02 82.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.709 -179.318 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.679 HD11 HD11 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -59.95 -60.2 4.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.648 0.261 . . . . 0.0 111.072 179.944 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.405 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 10.8 pt-20 -59.44 -29.36 67.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.262 179.486 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -70.67 -36.86 73.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.758 0.313 . . . . 0.0 110.761 179.647 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.436 HG23 ' HG2' ' A' ' 50' ' ' GLN . 94.2 mt -80.3 -61.51 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.528 -179.692 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.44 122.47 0.01 OUTLIER Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.664 -179.846 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.436 ' O ' HG23 ' A' ' 85' ' ' VAL . . . 145.91 171.02 15.05 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.624 -179.992 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.63 -26.97 68.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.643 0.258 . . . . 0.0 111.384 -179.752 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.508 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -62.22 -49.26 76.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.028 0.442 . . . . 0.0 110.288 179.785 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.581 HG11 ' HA ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -70.85 -23.73 24.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.16 179.947 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 82' ' ' GLY . 98.5 mtt180 -58.64 -27.76 65.03 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.871 0.367 . . . . 0.0 110.558 179.533 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 91' ' ' LYS . . . -72.34 -29.09 63.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.145 179.585 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.36 -45.39 63.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.843 179.738 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.511 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.29 -33.08 71.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.886 0.374 . . . . 0.0 110.26 179.562 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.96 -34.67 76.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.921 178.915 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 29.8 mmmt -61.0 -40.77 94.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.978 179.223 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.845 HD11 HD13 ' A' ' 62' ' ' LEU . 66.1 mt -71.21 -38.54 72.03 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.988 179.836 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.458 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -52.76 -27.7 19.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.441 179.84 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -97.49 -10.49 25.25 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 -179.404 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.473 ' OG1' ' HA ' ' A' ' 92' ' ' LEU . 47.4 p -106.16 -31.42 8.69 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.72 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.556 ' HA2' ' HD3' ' A' ' 101' ' ' ARG . . . 52.67 92.9 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.877 -179.866 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.441 ' H ' ' HB2' ' A' ' 101' ' ' ARG . 79.7 m -140.24 129.23 23.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.39 . . . . 0.0 111.575 179.934 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.439 ' HA3' HH22 ' A' ' 70' ' ' ARG . . . 38.72 -127.88 1.88 Allowed Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.548 -0.751 . . . . 0.0 113.767 179.498 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.437 ' HD1' ' H ' ' A' ' 99' ' ' PHE . 0.4 OUTLIER -92.81 -21.88 19.64 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.479 0.18 . . . . 0.0 110.982 -179.703 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.701 ' H ' HH21 ' A' ' 70' ' ' ARG . . . -49.93 -40.03 42.21 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.009 0.433 . . . . 0.0 110.654 179.815 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.556 ' HD3' ' HA2' ' A' ' 96' ' ' GLY . 30.7 tpt85 -57.27 -61.56 2.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.639 179.508 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -55.66 -39.55 71.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.155 179.392 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 99' ' ' PHE . 35.3 t -60.88 -36.69 73.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.112 179.901 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.557 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -63.42 -60.95 2.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.858 -179.169 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.555 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 58.6 t -60.89 -40.49 85.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.844 -179.205 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -71.1 -28.66 64.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.823 179.743 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.405 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 4.5 t80 -63.51 -50.31 70.11 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -177.8 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 3.2 pp -52.33 -13.32 0.33 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.496 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -78.05 5.91 8.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.962 0.41 . . . . 0.0 110.715 179.335 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.5 m -124.47 -59.6 1.45 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.08 179.94 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 53.1 p-80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.442 179.807 . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 pmm? . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.836 0.35 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.91 -178.97 6.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.028 -179.961 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -92.09 -33.24 14.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.093 179.986 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -92.49 -20.33 21.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.812 179.767 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -119.86 131.08 55.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.137 179.992 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -127.99 1.11 5.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.473 -179.963 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -141.86 -144.8 0.16 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.457 179.885 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 35.7 t 70.19 -83.14 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.722 179.57 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.536 ' HE ' ' HA ' ' A' ' 13' ' ' SER . 13.9 ptm180 -121.54 27.37 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.743 0.306 . . . . 0.0 111.483 -179.466 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 78.1 ttt180 -59.09 104.41 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.932 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.436 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 13.6 m-20 67.92 -0.85 1.89 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 -179.468 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.523 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 97.9 t -91.82 -37.92 9.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.971 -179.932 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.536 ' HA ' ' HE ' ' A' ' 9' ' ' ARG . 40.0 t 56.65 -88.48 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.608 179.873 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.7 p -81.79 91.99 6.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.935 0.398 . . . . 0.0 111.154 -179.917 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.438 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . . . -95.26 -1.98 50.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.518 -179.642 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.502 HD22 ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -79.28 -13.72 59.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.772 -179.707 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 75.1 m -54.2 -50.78 66.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.321 -179.862 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -174.96 31.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.046 0.451 . . . . 0.0 110.867 -179.689 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 17.2 mmm -103.85 -42.3 5.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.91 -179.709 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.93 172.52 6.6 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.347 -179.803 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 65.56 -73.99 0.06 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.741 0.305 . . . . 0.0 111.373 -179.987 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.6 -43.37 65.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.009 -179.775 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.475 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.56 20.49 18.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.777 -179.535 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.522 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -63.2 -49.68 73.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.026 0.441 . . . . 0.0 110.649 179.933 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -63.32 -53.43 53.17 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.116 179.838 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.475 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 83.7 Cg_exo -41.73 -24.57 0.27 Allowed 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 122.327 2.018 . . . . 0.0 111.961 179.554 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 70.2 mt -75.91 -57.02 4.12 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.473 178.997 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.657 HD12 HD12 ' A' ' 31' ' ' LEU . 28.5 tp -62.86 -24.56 67.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.101 179.938 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.2 -45.93 37.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 -179.598 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.2 p -63.29 -15.02 55.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.348 -179.8 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.657 HD12 HD12 ' A' ' 28' ' ' LEU . 57.0 mt -63.7 -10.96 22.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.84 0.352 . . . . 0.0 111.03 179.982 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.7 t -95.82 23.33 6.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.679 179.864 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.594 HD21 ' HB2' ' A' ' 39' ' ' ARG . 1.3 p30 -88.7 148.06 24.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.95 -179.614 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -65.6 -29.25 69.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.534 -179.386 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -77.88 163.63 25.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 0.0 111.066 -179.782 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -105.04 -24.94 12.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.594 -179.879 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 56.0 mtm180 -60.9 -39.13 88.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.193 179.736 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.7 mt -79.0 -45.57 24.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.453 -179.508 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.594 ' HB2' HD21 ' A' ' 33' ' ' ASN . 32.0 ttm180 -59.51 -41.3 89.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.23 -179.52 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.684 ' HA2' HD21 ' A' ' 61' ' ' LEU . . . -65.09 -62.84 4.59 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.001 -179.534 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.92 -24.74 2.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.745 0.307 . . . . 0.0 111.187 179.984 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.423 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -63.07 -55.01 29.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.758 179.465 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.403 ' HA ' ' CG2' ' A' ' 46' ' ' ILE . . . -68.02 -22.51 64.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.957 0.408 . . . . 0.0 110.716 179.71 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.404 ' CD1' ' HA3' ' A' ' 72' ' ' GLY . 4.3 m95 -56.91 -47.11 81.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.588 -179.967 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.47 HD12 ' N ' ' A' ' 45' ' ' ILE . 4.4 mp -99.5 -20.69 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.0 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.656 HG23 ' HB1' ' A' ' 54' ' ' ALA . 4.1 tt -55.43 -39.21 52.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -178.269 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.509 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -75.45 -11.44 84.29 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.512 -179.079 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -70.69 -10.98 60.63 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.149 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -95.59 -4.19 45.01 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.403 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.567 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.9 OUTLIER 46.41 56.27 6.54 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 179.494 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -127.3 151.29 48.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.893 0.377 . . . . 0.0 110.886 179.723 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.466 ' O ' HG12 ' A' ' 55' ' ' VAL . 9.4 pt-20 -59.8 -22.9 62.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.833 179.717 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.45 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -65.82 -30.64 71.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.643 179.685 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.656 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -102.18 30.54 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.471 -178.967 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.556 HG13 ' N ' ' A' ' 56' ' ' GLU . 9.9 p -91.39 -54.33 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.62 -179.964 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.556 ' N ' HG13 ' A' ' 55' ' ' VAL . 10.5 tt0 -61.0 -49.7 87.89 Favored Pre-proline 0 CA--C 1.536 0.406 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.797 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.5 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 81.5 Cg_exo -43.53 -36.73 7.26 Favored 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.5 2.133 . . . . 0.0 113.023 -179.313 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.656 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 27.5 mt -71.24 -47.14 59.0 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.07 -179.658 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.43 ' HA ' HD21 ' A' ' 62' ' ' LEU . 25.3 mt -59.4 -49.38 83.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.969 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.08 -26.81 64.17 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -177.759 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.684 HD21 ' HA2' ' A' ' 40' ' ' GLY . 21.8 tp -90.08 -30.62 17.58 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -178.236 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.612 HD11 HD22 ' A' ' 92' ' ' LEU . 4.0 pp -68.49 -8.9 45.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.121 0.486 . . . . 0.0 110.703 -179.124 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -112.32 0.27 15.64 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.018 179.298 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -61.92 -31.76 72.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.793 -179.668 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.553 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 14.6 t70 59.77 24.8 13.76 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.684 179.576 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.38 -20.61 43.65 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.028 0.442 . . . . 0.0 110.076 179.392 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 128.45 -110.03 1.08 Allowed Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.726 179.49 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -56.86 -23.97 48.19 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.846 0.355 . . . . 0.0 110.084 -179.949 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.589 ' HB ' HD11 ' A' ' 61' ' ' LEU . 3.7 m -69.15 -37.33 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-O 121.35 0.595 . . . . 0.0 110.013 179.298 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.553 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 3.8 ttm180 -63.0 -53.52 52.71 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.529 179.776 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 72.1 m -67.17 -38.7 85.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.424 179.935 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.404 ' HA3' ' CD1' ' A' ' 44' ' ' TRP . . . -52.53 -61.76 6.42 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.617 -179.668 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.656 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -59.06 -34.76 72.33 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.684 0.278 . . . . 0.0 111.073 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.412 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.2 -58.04 9.96 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.964 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 10.2 ptp180 -55.09 -34.39 63.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.507 -179.02 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.634 ' HA ' HE21 ' A' ' 79' ' ' GLN . 49.9 m -57.16 -34.03 68.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.641 0.258 . . . . 0.0 111.192 179.963 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.4 mp -60.47 -61.08 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.753 0.311 . . . . 0.0 110.977 179.592 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.424 ' HG2' ' HB2' ' A' ' 107' ' ' TYR . 42.9 mt-10 -64.47 -19.23 65.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.274 0.559 . . . . 0.0 110.102 179.073 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.634 HE21 ' HA ' ' A' ' 76' ' ' SER . 8.7 tt0 -70.78 -29.45 65.66 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.705 179.929 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.567 HG23 ' HG3' ' A' ' 50' ' ' GLN . 85.3 mt -84.52 -60.18 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.103 179.961 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.5 123.43 0.04 OUTLIER Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.623 179.908 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 137.45 172.88 12.69 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.576 179.802 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.25 -22.07 27.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.006 0.431 . . . . 0.0 111.074 179.826 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.582 ' HD3' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.94 -63.09 1.37 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.302 -179.872 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.546 HG21 ' HB ' ' A' ' 80' ' ' ILE . 20.3 t -70.67 -21.11 22.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.991 179.687 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.465 ' HA ' ' SD ' ' A' ' 89' ' ' MET . 68.3 mtt180 -53.31 -24.16 11.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.769 -179.529 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.87 -36.47 28.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.409 179.197 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.52 -39.33 70.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.872 -179.987 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.502 ' SD ' ' HB3' ' A' ' 108' ' ' LEU . 19.1 ptt? -63.75 -38.8 92.45 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -179.745 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -68.05 -26.49 65.88 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.446 178.656 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? -72.36 -41.94 65.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.483 179.403 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.612 HD22 HD11 ' A' ' 62' ' ' LEU . 8.8 mt -65.37 -38.42 89.98 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.604 179.917 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.75 -29.65 40.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.734 179.556 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -83.19 -24.62 32.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.352 179.049 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.3 p -114.58 31.49 6.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.178 179.367 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.531 ' HA3' HH11 ' A' ' 101' ' ' ARG . . . -45.96 99.15 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.698 -0.683 . . . . 0.0 113.291 -179.355 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.7 m -146.78 130.74 17.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.738 0.304 . . . . 0.0 110.28 179.618 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.87 -144.97 33.15 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.436 -0.888 . . . . 0.0 111.685 -179.386 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.45 -16.01 22.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.782 0.325 . . . . 0.0 110.547 179.604 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.437 ' HB1' HD13 ' A' ' 62' ' ' LEU . . . -55.79 -29.47 59.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.456 179.701 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.531 HH11 ' HA3' ' A' ' 96' ' ' GLY . 16.0 tpt180 -67.36 -57.67 6.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.996 178.844 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -49.38 -34.7 16.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.955 179.004 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.412 HG21 ' HB1' ' A' ' 74' ' ' ALA . 38.5 t -61.25 -55.45 24.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.15 179.785 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.565 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -56.18 -61.64 2.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.859 -179.277 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.482 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 45.1 t -50.76 -52.91 15.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.943 -179.304 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -71.13 -19.66 62.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.305 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.443 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 3.0 t80 -64.31 -51.83 61.49 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -177.721 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.502 ' HB3' ' SD ' ' A' ' 89' ' ' MET . 1.9 pp -52.07 -14.99 0.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.076 -178.982 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -72.41 3.33 4.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.727 0.299 . . . . 0.0 110.62 179.56 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.1 p -141.51 -47.95 0.39 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.268 -179.845 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 43.7 p-80 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.518 -179.971 . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.2 ttp . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 120.883 0.373 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.55 -28.95 68.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.502 -179.843 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -127.97 15.76 6.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.917 -179.655 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 63.65 153.51 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.946 -179.704 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -65.09 90.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.779 179.846 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.449 ' HB3' ' HD3' ' A' ' 10' ' ' ARG . 63.8 mttp -147.25 12.38 1.06 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.351 -179.789 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -120.12 24.43 10.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.701 0.286 . . . . 0.0 111.411 179.995 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 p -85.7 -34.87 8.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.583 -179.838 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.672 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 31.5 ttm180 -155.46 -9.86 0.12 Allowed 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.31 -179.837 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.449 ' HD3' ' HB3' ' A' ' 6' ' ' LYS . 38.0 mtp180 -61.58 109.05 1.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 177.502 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 4.5 m-20 66.85 30.49 7.82 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -177.194 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.672 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 5.0 p -42.27 150.59 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 CA-C-N 114.803 -1.09 . . . . 0.0 111.42 -179.129 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.468 ' H ' ' HG2' ' A' ' 18' ' ' ARG . 9.7 t -168.7 -73.93 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.058 -178.722 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.59 ' HB ' ' HB3' ' A' ' 17' ' ' SER . 3.1 m -66.85 168.12 10.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.61 179.763 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.511 ' H ' HG22 ' A' ' 14' ' ' THR . . . -95.29 -64.24 1.08 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.082 0.468 . . . . 0.0 111.491 -179.875 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.538 HD22 ' HG ' ' A' ' 27' ' ' LEU . 12.4 mt -71.57 -22.63 61.71 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.12 -178.595 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.59 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 23.1 t -87.0 -51.12 6.2 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.298 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.468 ' HG2' ' H ' ' A' ' 13' ' ' SER . 10.2 mpt_? -78.62 -72.59 0.37 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -178.829 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -73.46 27.33 0.07 Allowed 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.004 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.447 ' H ' ' C ' ' A' ' 18' ' ' ARG . . . -53.28 -173.16 0.05 OUTLIER Glycine 0 C--N 1.334 0.433 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.476 179.158 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' A' ' 20' ' ' GLY . 21.4 t70 68.41 -72.95 0.09 Allowed 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -178.803 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -65.58 -26.32 67.8 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.827 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.479 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . -105.49 20.27 19.17 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.497 179.212 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.701 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 4.2 t80 -63.45 -39.49 94.61 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.951 -179.962 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.428 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 39.1 mt-10 -57.27 -55.13 47.49 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.228 -179.312 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.479 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 91.8 Cg_exo -37.54 -30.24 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 C-N-CA 122.627 2.218 . . . . 0.0 111.997 179.079 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.575 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 22.7 mt -71.28 -58.71 3.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.828 179.212 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.569 ' HA ' HD12 ' A' ' 31' ' ' LEU . 41.9 tp -62.8 -21.45 65.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.896 179.997 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -79.55 -47.76 14.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.669 -179.905 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.8 m -66.41 -13.3 60.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.76 -179.758 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.569 HD12 ' HA ' ' A' ' 28' ' ' LEU . 46.8 mt -62.59 -10.27 11.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.658 0.266 . . . . 0.0 111.344 -179.733 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 35.9 m -89.96 6.88 40.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.893 179.933 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.603 HD22 ' HB ' ' A' ' 38' ' ' ILE . 21.6 p-10 -83.4 141.01 32.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.145 0.498 . . . . 0.0 111.327 -179.827 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.88 -9.57 45.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.855 -179.745 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.443 ' HB3' ' ND2' ' A' ' 33' ' ' ASN . 8.8 t70 -78.61 147.53 33.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.815 0.34 . . . . 0.0 111.108 -179.495 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.8 p-90 -98.62 -37.31 9.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.345 -179.792 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.2 tpt180 -59.51 -43.26 93.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.167 -179.877 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.603 ' HB ' HD22 ' A' ' 33' ' ' ASN . 44.7 mt -78.07 -49.48 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.219 -179.784 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.565 ' HE ' HG11 ' A' ' 69' ' ' VAL . 42.8 ttp180 -54.87 -30.92 59.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.853 179.824 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.09 -58.92 6.25 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.52 -179.926 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.56 -27.73 2.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.774 0.321 . . . . 0.0 111.329 -179.942 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.437 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.32 -51.96 66.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 179.797 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.554 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -73.17 -31.01 63.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.174 179.867 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.6 m95 -55.92 -37.64 69.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.441 -179.632 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.5 mt -99.56 -22.91 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.078 0.466 . . . . 0.0 110.907 -179.626 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.555 HG12 ' HA ' ' A' ' 54' ' ' ALA . 0.0 OUTLIER -51.35 -39.56 21.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.33 -178.853 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -76.86 -25.7 64.09 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.655 -0.783 . . . . 0.0 113.767 -178.868 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -70.82 -2.05 13.6 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -178.769 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.457 ' HB2' ' HE2' ' A' ' 24' ' ' PHE . 22.4 m-30 -112.71 -12.47 13.37 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.437 -0.505 . . . . 0.0 112.2 -179.449 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.524 ' HG2' HG23 ' A' ' 80' ' ' ILE . 0.6 OUTLIER 53.21 68.93 0.76 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.796 0.332 . . . . 0.0 111.212 179.331 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -127.48 164.25 22.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.869 0.366 . . . . 0.0 111.026 179.963 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -63.34 -43.72 96.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.78 179.564 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -6.53 21.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.29 -179.991 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.701 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -93.89 1.44 56.36 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.037 0.446 . . . . 0.0 111.041 -178.926 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.7 t -91.34 -49.13 13.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.24 -178.728 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.472 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 43.6 tt0 -60.23 -48.79 93.27 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.105 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.472 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 93.6 Cg_exo -43.06 -42.93 9.66 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.381 2.054 . . . . 0.0 112.873 -179.878 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.48 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 4.0 mt -66.35 -36.68 83.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.265 -179.284 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 29.2 mm -59.45 -59.03 4.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.192 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -70.05 -20.79 63.22 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.355 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.667 ' HG ' ' HB ' ' A' ' 69' ' ' VAL . 5.3 mp -83.38 -46.06 12.99 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -178.385 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.479 HD13 HD22 ' A' ' 92' ' ' LEU . 52.9 mt -61.37 -10.9 8.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.091 0.472 . . . . 0.0 110.5 -179.338 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.75 -17.05 13.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.285 179.126 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -62.09 -38.84 90.4 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.936 -179.68 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.566 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 5.3 m-20 57.74 27.39 14.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.712 -179.947 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.81 -25.67 59.18 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.003 0.43 . . . . 0.0 110.326 179.557 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 120.7 -82.12 0.34 Allowed Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.408 179.861 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.74 -33.23 75.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.295 0.569 . . . . 0.0 109.613 179.179 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.667 ' HB ' ' HG ' ' A' ' 61' ' ' LEU . 3.2 m -71.91 -42.14 69.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.473 -179.767 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.566 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 25.7 ttp180 -75.48 -47.57 26.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.076 -179.172 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 46.6 t -58.81 -50.29 74.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.482 179.605 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.9 -51.04 56.13 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.918 179.486 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.48 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -56.52 -33.42 66.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.673 0.273 . . . . 0.0 110.977 179.364 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.91 -54.19 45.39 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.54 -179.546 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.41 ' H ' ' HG2' ' A' ' 75' ' ' ARG . 10.2 ptp180 -69.76 -19.5 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.732 -179.589 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 59.8 m -58.74 -47.59 84.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.576 -179.863 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.468 ' HA ' HG21 ' A' ' 85' ' ' VAL . 6.3 mp -56.44 -54.9 40.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.846 -179.973 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.459 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 47.0 mt-10 -49.07 -34.0 12.76 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.422 179.463 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -69.91 -41.62 74.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.015 -179.997 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.524 HG23 ' HG2' ' A' ' 50' ' ' GLN . 88.4 mt -69.3 -61.02 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.943 179.645 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.49 113.83 0.01 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.119 -0.562 . . . . 0.0 112.989 179.658 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.433 ' O ' HG12 ' A' ' 85' ' ' VAL . . . 156.01 175.2 26.73 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.781 179.709 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.26 -23.34 61.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.841 0.353 . . . . 0.0 110.802 179.724 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.639 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.83 -45.48 61.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.046 -179.796 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.639 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 8.8 p -71.05 -26.47 27.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.231 0.538 . . . . 0.0 110.647 179.761 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.429 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 6.1 ttt180 -53.76 -28.76 36.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.798 179.581 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.18 -32.12 73.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.717 179.71 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.18 -57.89 10.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.343 -179.972 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.577 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.15 -24.61 65.0 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.822 -179.886 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.402 ' N ' ' SD ' ' A' ' 89' ' ' MET . 2.1 tm-20 -63.89 -44.19 93.77 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.119 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -72.22 -22.22 61.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.114 179.533 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.534 HD21 ' O ' ' A' ' 100' ' ' ALA . 0.3 OUTLIER -86.57 -28.54 23.25 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 120.81 0.338 . . . . 0.0 110.269 179.978 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.0 -19.15 65.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.948 179.667 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -84.56 -24.9 29.04 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.177 179.619 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 42.5 p -120.38 19.06 12.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.893 179.101 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -49.75 121.27 9.02 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.271 -179.263 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.6 t -142.59 130.66 21.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.842 0.354 . . . . 0.0 110.987 179.556 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.85 -136.53 46.42 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.677 -179.943 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.502 ' O ' HG23 ' A' ' 103' ' ' VAL . 48.1 t80 -66.25 -34.86 78.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.786 0.327 . . . . 0.0 111.012 179.997 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.534 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.59 -33.84 34.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.979 -179.59 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.0 ttp180 -72.63 -55.36 6.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.512 -179.408 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -49.25 -21.64 0.86 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.233 0.54 . . . . 0.0 110.484 179.722 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 99' ' ' PHE . 55.2 t -71.01 -58.77 4.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.609 179.81 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.577 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.88 -47.57 82.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.276 0.56 . . . . 0.0 112.368 -179.278 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.533 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 40.2 t -64.91 -51.5 65.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.342 -0.844 . . . . 0.0 112.878 -178.042 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -64.0 -45.36 89.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.671 0.272 . . . . 0.0 111.519 -179.248 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.459 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 61.1 t80 -60.44 -22.55 63.56 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.68 -179.049 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.533 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.0 OUTLIER -55.13 -18.11 5.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.089 179.884 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -71.47 -1.3 12.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.813 179.691 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 4.0 m -145.45 32.75 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.443 -179.981 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.1 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.961 179.84 . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 mmt . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.818 0.342 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.4 ' HB1' ' HG2' ' A' ' 4' ' ' GLU . . . -106.8 -17.83 14.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.548 179.444 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 58.09 13.71 2.37 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.298 179.754 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.4 ' HG2' ' HB1' ' A' ' 2' ' ' ALA . 9.9 pt-20 -130.91 -0.04 4.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.514 179.87 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 -110.14 105.11 14.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.758 179.935 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.416 ' H ' ' H ' ' A' ' 7' ' ' TRP . 22.1 pttp -161.64 -9.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.688 -179.915 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.416 ' H ' ' H ' ' A' ' 6' ' ' LYS . 27.5 p-90 -126.5 25.88 6.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.712 -179.825 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.439 ' C ' ' H ' ' A' ' 10' ' ' ARG . 9.2 p -72.9 145.81 11.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.209 -179.915 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.5 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 38.1 ttm180 71.91 -18.92 0.29 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.627 179.661 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.484 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 29.5 mtp180 -62.96 104.09 0.52 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 178.439 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.484 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 15.9 m-20 70.65 12.19 7.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.449 -179.473 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.588 HG13 ' N ' ' A' ' 13' ' ' SER . 12.7 p -54.5 -54.04 25.67 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.606 -179.86 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.588 ' N ' HG13 ' A' ' 12' ' ' VAL . 34.9 t 51.95 -88.17 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.471 179.31 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 12' ' ' VAL . 32.3 p -70.5 172.31 8.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.583 179.453 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.69 -70.38 0.72 Allowed 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.183 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.532 HD22 ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -87.88 -20.88 25.4 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.35 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.473 ' N ' HD13 ' A' ' 16' ' ' LEU . 34.0 m -71.86 -51.48 22.13 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.55 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.3 ttm180 -138.15 98.8 3.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.05 0.452 . . . . 0.0 111.682 -179.424 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.732 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -134.42 -42.96 0.77 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.784 179.519 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.429 ' N ' ' SD ' ' A' ' 19' ' ' MET . . . 95.47 -36.86 3.62 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.247 179.709 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -160.08 -16.58 0.06 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -179.348 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -67.64 -44.68 77.35 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -178.994 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.732 ' HB3' ' HG2' ' A' ' 19' ' ' MET . . . -106.33 -0.47 24.27 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.654 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.574 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -52.25 -50.17 62.59 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.975 0.417 . . . . 0.0 110.463 179.553 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.495 ' HA ' HD23 ' A' ' 28' ' ' LEU . 3.7 mt-10 -63.36 -57.87 18.31 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.802 179.636 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.61 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 74.6 Cg_exo -43.73 -30.88 3.1 Favored 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 122.077 1.851 . . . . 0.0 111.554 179.795 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.574 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 36.6 mt -62.8 -56.85 13.75 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.354 178.918 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.588 HD22 ' HB2' ' A' ' 53' ' ' ARG . 0.9 OUTLIER -69.82 -19.6 63.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.126 179.515 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -73.33 -39.57 65.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.781 179.552 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.0 m -66.42 -7.18 17.7 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.116 179.778 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.49 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 96.4 mt -61.24 -19.87 62.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.914 0.388 . . . . 0.0 110.479 179.626 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 83.4 p -92.51 12.05 24.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.074 179.968 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -72.55 139.15 47.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.777 -179.762 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.39 -31.78 73.03 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.855 -179.942 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -77.39 147.97 35.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.495 179.782 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 25.8 p-90 -89.44 -40.24 12.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.463 -179.473 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -60.28 -25.52 65.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.913 0.387 . . . . 0.0 110.723 179.756 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.3 mm -81.08 -47.77 19.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.087 179.974 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.49 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 49.4 ttp180 -63.73 -22.08 66.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.877 179.901 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.48 ' HA2' ' HA ' ' A' ' 69' ' ' VAL . . . -69.04 -59.16 6.09 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.606 -179.885 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' ' 44' ' ' TRP . . . -50.26 -20.37 1.04 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.704 0.288 . . . . 0.0 111.597 180.0 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.86 -55.09 37.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.354 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.592 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -73.81 -25.47 60.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.175 -179.959 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.403 ' HB2' ' HA ' ' A' ' 41' ' ' ALA . 6.7 m95 -55.46 -36.95 67.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.211 -179.586 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.0 mt -100.1 -26.14 3.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.039 0.447 . . . . 0.0 111.128 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.592 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 0.9 OUTLIER -56.3 -46.61 81.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.34 -178.873 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.406 ' N ' HG22 ' A' ' 46' ' ' ILE . . . -61.35 -21.61 60.08 Favored Glycine 0 CA--C 1.518 0.281 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.391 -179.058 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -70.71 -20.9 62.62 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 -179.064 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -92.08 -28.78 16.92 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.142 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 63.72 27.31 14.71 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 179.367 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.511 ' O ' HG23 ' A' ' 55' ' ' VAL . 12.0 t70 -96.12 170.03 9.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.767 0.317 . . . . 0.0 111.272 -179.866 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -54.12 -52.09 62.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.038 179.672 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.588 ' HB2' HD22 ' A' ' 28' ' ' LEU . 3.2 ptt180 -61.6 -8.47 4.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.225 179.66 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.543 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -104.97 -21.0 13.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.92 0.391 . . . . 0.0 111.067 -179.691 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 51' ' ' ASP . 69.5 t -73.58 -54.17 16.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.694 -179.633 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.452 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 25.5 tt0 -54.21 -47.7 96.57 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -179.527 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.501 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 97.2 Cg_exo -42.08 -46.92 7.02 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 122.489 2.126 . . . . 0.0 112.561 179.623 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.553 HD13 HD22 ' A' ' 77' ' ' LEU . 6.1 mt -63.48 -42.34 98.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.938 -179.592 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.0 mm -51.46 -54.84 10.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.345 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -70.06 -47.89 60.09 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.278 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.682 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.1 mp -60.17 -40.55 90.35 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.054 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.637 HD11 HD21 ' A' ' 77' ' ' LEU . 37.2 mt -56.77 -15.71 5.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.287 0.565 . . . . 0.0 109.999 -179.555 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -99.57 -30.98 11.83 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.293 178.235 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -62.21 87.77 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.174 178.957 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.465 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 16.6 m-20 -73.91 41.91 0.13 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.246 -178.798 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.9 t -85.75 -30.82 22.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.782 0.325 . . . . 0.0 111.125 179.763 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 126.46 -106.54 0.85 Allowed Glycine 0 C--O 1.228 -0.267 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.996 -179.686 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -46.7 -29.73 2.03 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.631 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.682 HG12 ' HG ' ' A' ' 61' ' ' LEU . 47.0 t -68.19 -54.98 18.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.963 179.559 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.465 ' HE ' ' HA ' ' A' ' 65' ' ' ASP . 0.2 OUTLIER -66.79 -54.69 20.07 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.257 179.736 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.3 m -50.95 -31.3 17.37 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.536 -179.614 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.46 -46.12 95.0 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.429 179.922 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.438 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . . . -70.21 -32.94 71.06 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 -179.837 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.34 -61.53 2.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.817 0.342 . . . . 0.0 111.648 -179.189 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 75' ' ' ARG . 6.4 ptp180 -60.68 -20.48 61.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.746 -179.425 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.2 m -67.15 -36.03 80.96 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.27 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.637 HD21 HD11 ' A' ' 62' ' ' LEU . 4.2 mm? -54.81 -61.05 2.56 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.724 0.297 . . . . 0.0 111.416 179.748 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.5 ' HG2' ' HD1' ' A' ' 107' ' ' TYR . 37.6 mt-10 -56.36 -41.28 75.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.889 179.567 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -62.32 -40.96 98.06 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -178.772 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 72.9 mt -60.74 -59.77 3.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -179.176 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.492 ' H ' HG21 ' A' ' 85' ' ' VAL . . . 174.59 -124.92 1.05 Allowed Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.09 -1.053 . . . . 0.0 113.392 179.938 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.456 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . -146.64 -66.67 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.411 -0.899 . . . . 0.0 113.748 -179.099 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.59 -27.08 63.83 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.335 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.565 ' HD3' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -85.05 -48.34 9.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.863 0.363 . . . . 0.0 110.517 -179.277 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.579 HG12 HD13 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -70.85 -20.77 22.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.723 178.858 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -47.28 -29.66 2.6 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.637 179.088 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.74 -36.84 50.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.75 179.963 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.91 -47.64 84.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.919 179.615 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.664 ' HE3' ' HG3' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -67.6 -30.29 69.84 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.509 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.664 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 22.1 mt-10 -66.49 -33.89 76.71 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.122 179.171 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -70.72 -38.67 73.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.113 179.788 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.54 HD21 ' O ' ' A' ' 100' ' ' ALA . 0.1 OUTLIER -82.05 -23.66 35.74 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.652 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.31 -26.36 68.73 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.298 179.024 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -80.22 -26.76 38.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.708 179.887 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 58.3 p -112.54 23.02 14.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.171 178.54 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.452 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -56.07 116.1 6.92 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.064 -0.971 . . . . 0.0 113.508 -178.958 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.8 t -147.79 130.32 15.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.741 0.305 . . . . 0.0 110.72 179.05 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.07 -142.19 48.41 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.734 -179.833 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -62.54 -29.45 70.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 111.009 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.54 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -56.24 -37.63 70.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.505 -179.747 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.452 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 18.0 ttp180 -70.91 -55.55 8.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.622 -179.594 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 57.7 tttp -47.67 -23.18 0.63 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.163 0.506 . . . . 0.0 110.948 -179.872 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.431 HG11 HD22 ' A' ' 62' ' ' LEU . 17.8 t -68.4 -60.43 2.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.73 179.903 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.5 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.6 -56.28 24.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.38 -179.156 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.424 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 19.4 t -56.42 -63.17 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.026 -178.245 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 106' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 15.0 m120 -57.08 -27.72 61.99 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -178.674 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.5 ' HD1' ' HG2' ' A' ' 78' ' ' GLU . 4.4 t80 -59.83 -31.09 69.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.362 . . . . 0.0 110.359 179.768 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.424 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 16.6 mt -52.65 -23.77 7.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.107 179.619 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -58.87 -8.75 1.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.215 179.747 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.5 p -93.19 -54.0 3.89 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.553 179.443 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 61.7 m80 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.322 -0.847 . . . . 0.0 110.932 179.843 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.438 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 CA--C 1.519 -0.215 0 CA-C-O 120.734 0.302 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.46 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 2.5 t80 -63.2 -51.57 65.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.244 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -63.4 -55.25 37.08 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.832 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.438 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 44.2 Cg_exo -50.91 -24.9 14.64 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 121.782 1.654 . . . . 0.0 110.349 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.666 HD21 HG13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -76.4 -41.75 46.77 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 114.207 -1.361 . . . . 0.0 109.218 178.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 31' ' ' LEU . 16.5 tp -70.47 -27.14 63.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.207 178.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -65.93 -41.11 91.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.124 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -61.38 -17.77 55.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.035 -0.53 . . . . 0.0 112.008 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 28' ' ' LEU . 80.1 mt -69.37 -11.89 61.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.788 0.328 . . . . 0.0 111.333 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.2 t -109.82 0.82 18.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.825 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -67.92 139.03 56.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.722 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -67.53 -24.03 65.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.315 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.67 139.79 33.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.919 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.1 p-90 -88.1 -26.4 22.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -64.08 -41.55 97.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.004 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.7 mt -80.18 -41.54 21.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.811 0.338 . . . . 0.0 111.122 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.536 ' HE ' HG21 ' A' ' 69' ' ' VAL . 54.1 ttp180 -59.48 -24.52 63.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.592 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.31 -63.61 3.85 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.635 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.61 -37.9 6.05 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.652 0.263 . . . . 0.0 111.258 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.438 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -57.45 -54.21 49.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.323 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.35 -30.81 71.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.703 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -68.47 -34.45 75.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.906 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.0 mt -99.37 -19.36 5.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.343 . . . . 0.0 111.762 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.666 HG13 HD21 ' A' ' 27' ' ' LEU . 3.9 tt -58.38 -34.92 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.24 -17.11 80.27 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.138 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -70.58 -7.15 41.87 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -99.18 -22.17 15.77 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.499 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.7 mp0 55.96 54.4 8.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 111.391 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -127.47 166.92 17.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.809 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -63.6 -29.11 70.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.663 ' HD2' HD22 ' A' ' 28' ' ' LEU . 1.1 ttp180 -66.33 -11.69 52.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.965 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.458 ' HA ' ' HG2' ' A' ' 57' ' ' PRO . . . -104.94 -13.59 15.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 86.8 t -68.9 -51.31 45.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.088 -179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.488 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 21.1 tt0 -59.75 -49.63 90.76 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.488 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.2 Cg_exo -41.22 -52.24 3.6 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.371 2.047 . . . . 0.0 112.898 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.627 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 5.2 mt -60.03 -36.93 78.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.384 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.6 mm -55.02 -59.83 2.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.875 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.44 ' HG3' HD13 ' A' ' 61' ' ' LEU . 3.9 ptpp? -70.76 -40.12 72.87 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.719 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -57.86 -51.58 69.03 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.465 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.799 HD13 HD22 ' A' ' 92' ' ' LEU . 33.5 mt -55.96 -10.34 0.77 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.716 0.294 . . . . 0.0 111.491 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.02 -20.32 13.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.991 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.419 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 6.5 m-20 -61.13 -40.3 93.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.714 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.446 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 29.5 t70 62.33 27.35 16.34 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.316 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.519 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 4.7 m -84.31 17.12 2.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.477 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.79 -96.58 0.68 Allowed Glycine 0 C--O 1.227 -0.337 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.747 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.09 -43.8 64.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.036 0.446 . . . . 0.0 110.61 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.719 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.8 t -73.35 -39.09 54.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.049 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.501 ' HG2' ' HA ' ' A' ' 62' ' ' LEU . 3.0 tmm_? -77.98 -63.6 1.35 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.668 0.27 . . . . 0.0 111.435 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 48.9 m -51.55 -32.25 27.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.305 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.438 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -63.4 -38.39 96.31 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.437 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.627 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -64.02 -37.37 87.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.704 0.288 . . . . 0.0 111.042 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.16 -57.14 14.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.762 -179.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 7.4 ptm85 -58.65 -26.93 64.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.618 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.2 m -58.49 -39.85 81.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.452 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.651 ' HA ' HG11 ' A' ' 85' ' ' VAL . 6.1 mp -59.79 -58.33 9.03 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.744 0.307 . . . . 0.0 110.631 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.456 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 54.1 mt-10 -48.96 -31.17 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.338 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -68.67 -41.93 78.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.141 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.499 HG23 ' HG3' ' A' ' 50' ' ' GLN . 35.3 mt -74.35 -60.87 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 63.14 117.6 0.01 OUTLIER Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.977 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.449 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 145.43 -173.05 25.98 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.753 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -69.45 -30.2 68.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.814 0.34 . . . . 0.0 110.902 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.553 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -52.85 -63.24 1.21 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.851 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.651 HG11 ' HA ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -70.93 -20.61 21.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.9 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 55.3 ttp180 -56.78 -26.35 57.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.253 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.16 -25.67 27.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.215 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.62 69.41 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.695 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.464 ' HB2' ' CB ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -69.09 -26.79 65.11 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.249 179.629 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 41.7 mt-10 -69.78 -32.26 70.64 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -76.76 -28.7 55.82 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.622 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.799 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -84.54 -30.08 25.39 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.515 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.57 -20.27 66.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.337 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -80.33 -26.86 38.54 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.674 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 51.3 p -118.2 24.4 10.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.827 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.425 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -55.85 116.41 7.19 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.338 -0.846 . . . . 0.0 113.261 -179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.3 t -140.52 130.24 24.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.828 0.347 . . . . 0.0 110.842 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.86 -135.67 51.79 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.631 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -67.64 -32.01 72.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.618 0.247 . . . . 0.0 111.315 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.548 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.84 -28.75 37.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.687 -179.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.425 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 21.9 ttp180 -75.22 -55.23 5.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.431 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -48.25 -26.95 2.19 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.21 0.529 . . . . 0.0 110.256 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.417 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 37.5 t -59.5 -60.04 3.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.868 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.62 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -62.59 -56.55 16.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.433 0.635 . . . . 0.0 111.957 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.589 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 54.8 t -52.38 -54.61 14.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 114.82 -1.082 . . . . 0.0 113.146 -178.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -70.74 -31.48 68.32 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.456 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 21.6 t80 -63.7 -50.96 67.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 4.3 pp -52.42 -15.02 0.55 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.456 -178.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -62.2 -13.71 30.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.088 0.47 . . . . 0.0 110.149 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.02 12.97 6.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.77 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.044 -0.979 . . . . 0.0 111.074 179.88 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.193 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.556 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -60.96 -53.86 52.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.154 0.502 . . . . 0.0 110.124 179.661 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -63.23 -54.92 40.97 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.013 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 91.9 Cg_exo -43.33 -26.38 0.93 Allowed 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.228 1.952 . . . . 0.0 111.458 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.556 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 43.5 mt -74.68 -55.3 6.03 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.937 178.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.608 HD12 HD11 ' A' ' 31' ' ' LEU . 38.1 tp -61.53 -20.96 63.81 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.599 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -80.68 -36.81 31.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.715 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.479 ' HB3' HG22 ' A' ' 38' ' ' ILE . 60.0 m -66.22 -42.42 88.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.859 -179.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.608 HD11 HD12 ' A' ' 28' ' ' LEU . 4.1 pp -63.32 -6.27 4.46 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.2 m -90.32 22.12 3.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.066 0.46 . . . . 0.0 110.525 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -117.5 144.58 44.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.029 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -65.89 -8.76 23.96 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.305 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -77.36 120.69 22.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.947 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -70.68 -35.88 73.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.827 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 53.1 ttp180 -60.11 -54.63 43.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.254 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.479 HG22 ' HB3' ' A' ' 30' ' ' SER . 64.0 mt -65.96 -45.65 90.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.804 0.335 . . . . 0.0 111.0 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.499 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.3 ttm180 -63.2 -20.69 65.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.58 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.65 -66.48 2.27 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.625 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.6 -40.31 19.03 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.688 0.28 . . . . 0.0 111.18 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.99 -52.72 63.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.075 0.464 . . . . 0.0 110.235 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.448 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -63.31 -36.19 82.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.665 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -63.16 -26.28 68.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.471 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 62.8 mt -99.26 -19.74 5.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.005 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.589 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.9 OUTLIER -55.39 -39.54 53.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.535 -179.738 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.19 -16.48 73.17 Favored Glycine 0 C--N 1.329 0.193 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.744 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.697 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.7 OUTLIER -64.0 -45.93 86.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.831 0.348 . . . . 0.0 110.379 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.443 ' C ' ' H ' ' A' ' 51' ' ' ASP . 85.2 m-85 -85.54 111.87 20.41 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.659 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.764 ' H ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -74.67 35.02 0.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.377 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.443 ' H ' ' C ' ' A' ' 49' ' ' PHE . 35.6 t70 -100.66 155.31 17.96 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.84 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.488 ' O ' HG12 ' A' ' 55' ' ' VAL . 12.2 pt-20 -63.06 -23.58 67.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.544 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.459 ' HD3' HD22 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -57.69 -41.15 81.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.81 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.589 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -97.37 24.55 6.41 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 52' ' ' GLU . 2.7 p -91.41 -37.75 9.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.941 0.4 . . . . 0.0 111.062 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.521 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 24.8 tt0 -60.45 -51.13 82.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.98 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.571 ' HG2' HG12 ' A' ' 46' ' ' ILE . 88.5 Cg_exo -42.81 -52.36 4.67 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.397 2.065 . . . . 0.0 112.761 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.59 HD13 HD23 ' A' ' 77' ' ' LEU . 49.6 mt -56.73 -41.23 77.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.596 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 25.3 mm -53.17 -60.12 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -71.87 -31.04 66.06 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.63 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -66.08 -44.19 85.15 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.657 HD13 HD11 ' A' ' 92' ' ' LEU . 12.0 mt -62.68 -8.96 7.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.967 0.413 . . . . 0.0 110.564 -178.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -126.95 -6.2 6.15 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.27 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.43 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 3.7 t70 -61.17 -33.05 72.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.28 0.562 . . . . 0.0 110.745 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 42.7 m-20 58.75 25.75 13.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.292 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.454 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.1 m -86.04 5.59 32.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.623 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.98 -103.95 2.63 Favored Glycine 0 C--O 1.227 -0.306 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.44 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -50.44 -39.79 48.58 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.182 0.515 . . . . 0.0 110.127 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.63 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.4 t -67.98 -38.29 79.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.539 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 27.0 ttp180 -76.61 -58.87 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.294 -179.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 62.0 p -50.87 -30.18 13.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.326 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.17 -37.02 94.23 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.616 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.455 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -77.08 -36.92 55.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.61 0.243 . . . . 0.0 111.507 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.45 ' HB2' ' HE1' ' A' ' 99' ' ' PHE . . . -54.98 -49.59 71.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.799 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 7.3 ptp180 -73.68 -33.8 64.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.283 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.529 ' HA ' HE21 ' A' ' 79' ' ' GLN . 19.8 m -56.5 -39.97 74.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.034 -179.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.59 HD23 HD13 ' A' ' 58' ' ' LEU . 90.1 mt -55.51 -59.58 4.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.747 0.308 . . . . 0.0 110.53 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -49.08 -29.99 5.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.804 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.529 HE21 ' HA ' ' A' ' 76' ' ' SER . 24.9 mt-30 -68.68 -41.71 78.86 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.949 0.404 . . . . 0.0 110.257 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.544 HG23 ' HG3' ' A' ' 50' ' ' GLN . 71.6 mt -69.22 -61.48 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.12 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.405 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 58.94 111.3 0.01 OUTLIER Glycine 0 CA--C 1.518 0.27 0 C-N-CA 121.156 -0.545 . . . . 0.0 113.155 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.415 ' H ' ' HB3' ' A' ' 111' ' ' HIS . . . 165.83 174.26 35.15 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.593 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.93 -22.59 66.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.834 0.349 . . . . 0.0 110.547 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.601 ' HD3' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -75.76 -33.7 60.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.619 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.601 ' N ' ' HD3' ' A' ' 84' ' ' ARG . 3.4 t -68.53 -32.68 56.29 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-O 121.333 0.587 . . . . 0.0 109.756 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 86' ' ' ARG . 9.3 ttt180 -52.48 -26.61 13.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.777 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.29 -41.61 66.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.503 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.04 -43.07 88.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.116 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.437 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.98 -36.27 77.67 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.786 0.327 . . . . 0.0 110.387 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.62 -31.38 72.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.078 0.466 . . . . 0.0 109.976 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -65.59 -39.1 91.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.85 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.69 HD12 ' HB2' ' A' ' 104' ' ' ALA . 29.4 mt -70.94 -40.23 72.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.562 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.46 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -55.79 -22.34 23.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.937 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -92.26 -23.43 19.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.978 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 71.5 p -121.64 39.01 3.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.822 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.413 ' CA ' ' HD3' ' A' ' 101' ' ' ARG . . . -38.42 104.67 0.03 OUTLIER Glycine 0 C--N 1.332 0.353 0 CA-C-N 115.761 -0.654 . . . . 0.0 113.611 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.2 p -144.8 132.18 20.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.838 0.351 . . . . 0.0 110.927 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.69 -143.58 46.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.477 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.45 ' HE1' ' HB2' ' A' ' 74' ' ' ALA . 10.6 p90 -84.16 -24.29 30.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.698 0.285 . . . . 0.0 110.819 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.624 ' HB1' HD13 ' A' ' 92' ' ' LEU . . . -44.9 -36.8 3.51 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.47 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.46 ' NE ' ' HA ' ' A' ' 93' ' ' ALA . 14.1 tpt180 -64.3 -61.88 1.96 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -54.46 -33.37 59.51 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.201 0.524 . . . . 0.0 110.261 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 43.3 t -65.19 -44.7 95.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.075 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.69 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -64.99 -59.02 4.63 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 61.1 t -55.15 -62.68 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.612 -178.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -55.46 -38.21 68.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.723 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.405 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 9.5 t80 -58.82 -44.66 90.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.906 0.384 . . . . 0.0 111.644 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.436 ' O ' HD12 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -51.1 -17.74 0.7 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.026 -178.522 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -61.11 -8.94 3.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 111.004 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 56.1 p -122.29 -41.8 2.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.179 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.415 ' HB3' ' H ' ' A' ' 82' ' ' GLY . 71.6 m80 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.809 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.423 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.675 0.274 . . . . 0.0 111.703 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.462 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 2.5 t80 -60.63 -46.54 89.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.508 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.42 -54.08 47.0 Favored Pre-proline 0 N--CA 1.466 0.329 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.431 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.423 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 53.0 Cg_exo -46.32 -23.88 2.28 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.902 1.735 . . . . 0.0 111.011 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.657 HD21 HG13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -83.96 -46.83 11.65 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 114.322 -1.308 . . . . 0.0 110.128 179.667 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.676 HD12 HD12 ' A' ' 31' ' ' LEU . 15.1 tp -69.13 -16.93 63.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.363 179.147 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -75.61 -36.57 60.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.771 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.4 m -66.34 -20.28 66.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.825 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.676 HD12 HD12 ' A' ' 28' ' ' LEU . 91.2 mt -65.86 -9.52 29.82 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.574 0.226 . . . . 0.0 111.542 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.5 m -101.5 11.69 38.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.079 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -71.47 148.04 47.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.018 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.43 -18.28 65.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.965 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -86.76 162.48 17.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.791 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -102.86 -39.62 6.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.798 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -58.74 -37.5 76.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.894 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.2 mm -61.59 -41.57 90.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.717 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.441 ' HB2' HG22 ' A' ' 69' ' ' VAL . 76.4 mtt180 -62.45 -24.5 67.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.398 179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.62 -64.36 3.63 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.858 -0.686 . . . . 0.0 112.197 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.74 -33.8 36.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.781 0.324 . . . . 0.0 110.948 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.34 -55.46 15.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.583 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.421 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -62.62 -26.01 68.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.742 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.435 ' NE1' ' HA2' ' A' ' 72' ' ' GLY . 5.3 m95 -70.63 -32.82 70.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.135 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.534 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 41.4 mt -99.46 -22.88 4.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.945 0.403 . . . . 0.0 111.41 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.657 HG13 HD21 ' A' ' 27' ' ' LEU . 4.4 tt -61.02 -37.56 77.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.19 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -78.08 -14.8 81.9 Favored Glycine 0 C--N 1.33 0.216 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.221 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.534 ' ND2' ' HA ' ' A' ' 45' ' ' ILE . 51.0 m-20 -70.74 -14.76 62.56 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -93.76 -10.31 34.67 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.454 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.7 OUTLIER 50.51 61.54 3.16 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.815 0.341 . . . . 0.0 111.412 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -127.93 161.68 28.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.164 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.69 -36.15 82.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.723 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -65.71 -9.06 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.046 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.462 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -102.99 -13.67 16.79 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.866 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 41.7 t -72.15 -38.87 64.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.439 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.503 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 26.4 tt0 -57.07 -51.51 81.15 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.624 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.508 ' HG2' HD13 ' A' ' 46' ' ' ILE . 89.6 Cg_exo -41.97 -51.64 4.5 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.261 1.974 . . . . 0.0 112.156 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.448 HD23 ' HG ' ' A' ' 77' ' ' LEU . 8.4 mp -52.69 -37.5 59.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.961 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.2 mm -56.58 -61.44 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -72.4 -10.41 59.76 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.505 ' HA ' ' HB2' ' A' ' 64' ' ' ASP . 1.8 mp -89.37 -49.39 6.73 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.615 HD13 HD22 ' A' ' 92' ' ' LEU . 11.4 mt -56.45 -15.52 4.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.851 0.358 . . . . 0.0 111.181 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -113.71 -11.82 12.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.505 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.7 OUTLIER -61.08 -46.09 92.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.056 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.591 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 14.4 t70 63.08 24.45 14.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.152 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.468 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.6 m -86.2 7.58 24.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.012 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.89 -108.47 3.52 Favored Glycine 0 C--O 1.229 -0.204 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.425 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -48.81 -30.9 6.25 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.257 0.551 . . . . 0.0 109.634 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 66' ' ' SER . 58.8 t -72.08 -50.81 34.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.783 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.591 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 38.3 ttp180 -68.2 -62.45 1.39 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.108 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.5 m -51.04 -27.67 8.52 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.957 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.435 ' HA2' ' NE1' ' A' ' 44' ' ' TRP . . . -57.84 -56.2 26.44 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.73 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.442 ' CB ' ' HA ' ' A' ' 58' ' ' LEU . . . -56.2 -46.15 79.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.854 0.359 . . . . 0.0 110.907 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.12 -27.18 63.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.775 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.414 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 27.3 ttt-85 -83.8 -34.6 24.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.814 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.463 ' HA ' HE21 ' A' ' 79' ' ' GLN . 47.5 m -61.98 -39.47 92.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.621 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.464 HD23 HG22 ' A' ' 85' ' ' VAL . 1.1 mt -59.25 -59.24 5.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.717 0.294 . . . . 0.0 111.411 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -48.93 -38.86 24.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.706 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.463 HE21 ' HA ' ' A' ' 76' ' ' SER . 41.4 mt-30 -70.81 -47.79 57.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.628 0.251 . . . . 0.0 111.37 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.581 HG21 ' HB ' ' A' ' 85' ' ' VAL . 90.0 mt -61.43 -60.63 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.36 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 53.88 70.55 0.9 Allowed Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.579 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -152.45 164.71 30.7 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.552 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -65.17 -27.64 68.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.848 0.356 . . . . 0.0 110.859 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.512 ' H ' ' CD ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -69.28 -50.99 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.875 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.581 ' HB ' HG21 ' A' ' 80' ' ' ILE . 9.9 p -70.77 -23.87 24.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.272 0.558 . . . . 0.0 110.331 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -53.46 -29.99 38.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.806 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 91' ' ' LYS . . . -65.87 -31.41 72.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.267 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.07 -51.38 69.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.968 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.552 ' HE3' ' O ' ' A' ' 104' ' ' ALA . 3.4 ppp? -69.72 -24.87 63.63 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.822 0.344 . . . . 0.0 110.387 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.432 ' N ' ' SD ' ' A' ' 89' ' ' MET . 28.2 mt-10 -68.17 -40.16 82.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.967 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 46.4 mmtm -78.78 -21.71 47.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.119 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.615 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -86.69 -30.33 21.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.786 0.327 . . . . 0.0 110.207 179.779 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.19 -26.81 67.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.975 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -80.11 -25.64 39.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.083 0.468 . . . . 0.0 110.288 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.2 p -117.4 24.42 11.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.349 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.472 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -58.24 121.68 27.04 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.153 -179.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 92.3 m -139.69 130.42 25.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.57 -0.315 . . . . 0.0 110.76 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.32 -133.8 52.6 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.759 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.54 ' O ' HG23 ' A' ' 103' ' ' VAL . 48.0 t80 -66.41 -33.78 76.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.787 0.327 . . . . 0.0 111.146 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.576 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.28 -38.69 54.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.014 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.472 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 39.9 ttt180 -70.44 -60.02 2.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.811 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -46.57 -25.2 0.65 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.155 0.503 . . . . 0.0 110.749 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 99' ' ' PHE . 37.1 t -67.7 -60.52 2.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.259 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.552 ' O ' ' HE3' ' A' ' 89' ' ' MET . . . -50.36 -59.65 3.77 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.5 t -58.4 -64.27 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -55.56 -38.34 69.21 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.42 ' HB3' ' O ' ' A' ' 103' ' ' VAL . 12.1 t80 -58.84 -48.19 82.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.867 0.365 . . . . 0.0 111.445 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -21.48 6.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.807 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -54.98 -21.3 11.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.864 0.364 . . . . 0.0 110.992 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.9 p -95.25 -49.11 5.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.146 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 73.4 m80 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.865 -179.98 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 -0.076 0 CA-C-O 120.824 0.345 . . . . 0.0 110.938 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.559 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -57.21 -50.83 71.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.702 -179.422 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.503 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.38 -55.71 33.25 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.634 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.503 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 87.6 Cg_exo -45.56 -27.81 3.8 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 122.093 1.862 . . . . 0.0 111.438 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 47.5 mt -71.17 -50.16 36.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.845 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.614 HD12 HD12 ' A' ' 31' ' ' LEU . 10.4 tp -73.08 -18.41 61.31 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.448 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -81.53 -39.52 24.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.389 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.5 t -66.39 -10.83 47.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.729 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.614 HD12 HD12 ' A' ' 28' ' ' LEU . 58.4 mt -63.51 -21.08 66.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.711 0.291 . . . . 0.0 111.116 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.9 p -104.52 8.77 35.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.844 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -64.65 150.37 47.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.149 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -67.86 -44.43 77.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.829 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -77.73 133.52 38.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.003 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.1 m0 -79.71 -22.44 43.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.675 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -61.99 -48.31 80.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.47 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.6 mt -75.46 -37.61 38.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.666 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.543 ' HG2' ' HA ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -61.64 -32.65 72.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.225 179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.44 -57.38 7.47 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.307 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.21 -29.18 1.48 Allowed 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 120.798 0.332 . . . . 0.0 111.287 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.67 -54.85 42.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.366 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.79 -29.29 70.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.673 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -65.29 -34.41 78.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.242 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.434 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 29.1 mt -101.05 -20.82 5.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.855 0.359 . . . . 0.0 111.599 -179.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.568 HD13 ' HG2' ' A' ' 57' ' ' PRO . 1.3 tt -60.42 -36.89 72.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.84 -8.23 72.32 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.244 -0.979 . . . . 0.0 112.703 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.644 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.7 OUTLIER -70.78 -22.75 62.34 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.568 0.21 . . . . 0.0 111.568 -179.503 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -88.24 -32.86 18.32 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.722 0.268 . . . . 0.0 111.722 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.595 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 36.3 mt-30 66.22 19.04 11.06 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.593 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -86.11 169.41 13.15 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.759 0.314 . . . . 0.0 110.804 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.67 -36.82 85.52 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.613 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 32.0 ttm180 -68.05 -9.88 49.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.815 0.34 . . . . 0.0 111.066 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -104.15 4.54 34.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.165 0.507 . . . . 0.0 110.41 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.3 t -91.12 -33.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.7 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.555 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.4 tm-20 -60.21 -50.24 86.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.766 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.568 ' HG2' HD13 ' A' ' 46' ' ' ILE . 82.4 Cg_exo -46.86 -49.4 12.46 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.304 2.003 . . . . 0.0 112.471 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.516 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 6.6 mt -58.84 -28.25 65.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.716 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.8 mm -63.38 -61.3 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 64' ' ' ASP . 21.8 ttpt -72.02 -39.17 69.36 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.609 ' HG ' HG12 ' A' ' 69' ' ' VAL . 2.4 mp -55.54 -51.32 67.46 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -178.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.496 HD11 HD21 ' A' ' 77' ' ' LEU . 49.9 mt -62.19 -10.19 9.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.109 0.48 . . . . 0.0 110.358 -179.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -113.91 -15.06 12.41 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.025 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' A' ' 60' ' ' LYS . 10.3 t0 -61.09 -47.72 84.98 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.383 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.507 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 5.7 m-20 62.55 28.15 16.57 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.458 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.455 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 48.1 t -84.8 -16.99 39.58 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 111.089 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 113.98 -104.82 1.5 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.026 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.16 -28.26 10.63 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.46 0.648 . . . . 0.0 109.301 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.609 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.8 t -73.67 -54.99 13.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.812 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.507 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 32.7 ttp180 -66.94 -61.52 1.9 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.047 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.0 t -52.06 -31.56 30.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.933 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.34 -35.33 90.8 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.321 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.516 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -84.68 -23.43 29.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.741 0.305 . . . . 0.0 111.045 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.407 ' O ' HD12 ' A' ' 77' ' ' LEU . . . -58.51 -52.87 63.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.153 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.537 ' H ' ' HG3' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -79.44 -17.28 54.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.012 179.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.514 ' HB2' HH21 ' A' ' 75' ' ' ARG . 48.3 t -63.48 -45.94 88.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.886 0.374 . . . . 0.0 110.497 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.602 HD13 ' HE1' ' A' ' 89' ' ' MET . 0.4 OUTLIER -56.84 -57.44 12.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.227 179.56 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -55.21 -34.45 63.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.53 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.52 ' NE2' HH22 ' A' ' 75' ' ' ARG . 10.7 tt0 -68.73 -23.78 64.39 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.964 0.412 . . . . 0.0 110.16 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.595 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 57.2 mt -81.95 -61.02 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.447 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 56.6 92.82 0.01 OUTLIER Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.718 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 173.26 172.13 38.51 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.595 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -63.69 -26.45 68.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.834 0.35 . . . . 0.0 110.948 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.561 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -61.78 -57.46 11.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.826 -179.684 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.478 HG21 ' HA ' ' A' ' 77' ' ' LEU . 9.9 p -70.68 -23.7 24.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.648 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.44 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 3.2 tmt_? -51.35 -33.46 29.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.375 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.18 -32.46 56.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.642 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.14 -36.5 73.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.748 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.629 ' HE2' ' HA ' ' A' ' 104' ' ' ALA . 1.6 mmm -69.8 -53.47 18.1 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.317 -0.401 . . . . 0.0 109.93 179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -54.22 -29.13 45.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.298 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -76.87 -32.08 57.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.55 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.549 HD23 ' HB2' ' A' ' 104' ' ' ALA . 1.3 tp -86.74 -29.44 22.37 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.936 0.398 . . . . 0.0 110.427 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.25 -31.77 65.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.887 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -80.16 -24.71 40.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.319 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.7 p -118.35 33.09 5.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.555 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.441 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -48.23 124.79 11.68 Favored Glycine 0 N--CA 1.449 -0.44 0 CA-C-N 114.951 -1.022 . . . . 0.0 114.085 -178.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 20.2 m -143.33 130.31 20.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.493 -0.354 . . . . 0.0 110.162 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 65.74 -142.41 43.65 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.347 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -81.6 -22.23 37.83 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.709 0.29 . . . . 0.0 110.933 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.49 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -49.92 -41.08 45.28 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.909 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.441 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 61.6 ttt180 -56.14 -60.88 2.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.739 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -54.69 -25.92 30.25 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.562 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.6 t -72.4 -50.83 32.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.742 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.629 ' HA ' ' HE2' ' A' ' 89' ' ' MET . . . -53.26 -55.53 23.76 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.8 t -60.81 -61.78 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.724 -178.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.424 ' HA ' ' OE2' ' A' ' 109' ' ' GLU . 13.1 m120 -56.35 -36.33 68.65 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -61.91 -30.74 71.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.963 0.411 . . . . 0.0 111.232 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.5 mt -56.27 -15.95 4.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.977 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.424 ' OE2' ' HA ' ' A' ' 106' ' ' ASN . 0.5 OUTLIER -75.23 1.21 14.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.434 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 61.4 p -111.81 -61.6 1.68 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.742 0.306 . . . . 0.0 111.023 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.814 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.585 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 120.974 0.416 . . . . 0.0 110.416 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 4.6 t80 -57.85 -60.19 4.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.406 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.527 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -63.51 -53.32 52.84 Favored Pre-proline 0 N--CA 1.466 0.328 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.863 -178.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.585 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 9.7 Cg_endo -51.56 -25.41 19.47 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 121.777 1.652 . . . . 0.0 110.513 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.624 HD21 HD13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -75.77 -40.59 55.0 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.128 178.064 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.632 HD22 ' HD3' ' A' ' 53' ' ' ARG . 6.1 tp -73.84 -20.46 60.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.137 177.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 25' ' ' GLU . 3.2 tm-20 -77.69 -40.97 39.66 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.599 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.7 m -61.76 -19.55 62.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.263 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.523 HD12 HD12 ' A' ' 28' ' ' LEU . 79.1 mt -66.85 -9.35 36.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.729 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.0 t -109.6 18.9 19.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.872 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.409 HD22 ' HA ' ' A' ' 33' ' ' ASN . 9.6 m120 -85.36 135.12 34.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.939 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -58.56 -25.51 62.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.786 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -83.67 153.69 24.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.729 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -104.89 -25.88 12.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -63.01 -36.59 84.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.867 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.5 mt -81.19 -36.94 15.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.8 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -63.91 -31.84 73.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -56.6 -57.08 21.29 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.354 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.34 -38.82 59.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.691 0.281 . . . . 0.0 110.977 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.43 -50.62 71.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.383 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.433 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -65.24 -35.29 80.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.745 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.4 m95 -66.1 -32.13 73.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.926 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.506 ' HA ' HD22 ' A' ' 48' ' ' ASN . 38.7 mm -99.41 -23.14 4.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.624 HD13 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -54.52 -37.82 39.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -178.536 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -67.68 -19.51 71.25 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.867 -0.682 . . . . 0.0 113.769 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.506 HD22 ' HA ' ' A' ' 45' ' ' ILE . 42.1 m-80 -70.69 -0.89 9.72 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -101.64 -26.26 13.58 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.491 ' HG2' HG23 ' A' ' 80' ' ' ILE . 19.6 mt-30 62.11 18.3 9.9 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -93.43 167.84 11.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.614 0.245 . . . . 0.0 110.692 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -62.32 -31.8 72.47 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.812 0.339 . . . . 0.0 110.684 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.632 ' HD3' HD22 ' A' ' 28' ' ' LEU . 34.4 ttm180 -69.2 -9.52 53.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.011 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.439 ' HA ' HD12 ' A' ' 46' ' ' ILE . . . -100.24 -7.54 24.54 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.207 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.4 t -91.14 -39.18 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.577 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.543 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 21.5 tt0 -60.51 -50.85 83.7 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.543 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 89.1 Cg_exo -47.8 -45.73 23.43 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.11 1.874 . . . . 0.0 112.029 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.63 HD22 ' HA ' ' A' ' 73' ' ' ALA . 4.6 mt -57.95 -31.47 66.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.639 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.407 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 50.9 mm -57.41 -61.54 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -11.75 60.79 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.684 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.3 mp -84.85 -49.63 8.24 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.715 HD13 HD22 ' A' ' 92' ' ' LEU . 8.8 mt -59.4 -10.05 2.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.17 0.51 . . . . 0.0 110.289 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 59' ' ' ILE . 8.2 pt-20 -115.42 -17.22 11.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.18 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -61.07 -32.81 72.45 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.151 0.501 . . . . 0.0 110.943 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.622 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 1.5 m-20 50.4 30.08 4.33 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.722 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.488 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 47.5 t -85.94 2.41 46.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.776 0.322 . . . . 0.0 111.094 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.28 -89.13 1.6 Allowed Glycine 0 C--O 1.228 -0.244 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.694 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -58.76 -38.55 78.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.932 0.396 . . . . 0.0 110.224 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.684 HG12 ' HG ' ' A' ' 61' ' ' LEU . 14.3 t -73.77 -49.23 36.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.233 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.622 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 45.9 ttp180 -62.48 -58.3 8.12 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.927 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 33.4 t -51.96 -26.76 11.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.771 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -60.12 -39.77 96.27 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.542 -0.837 . . . . 0.0 111.544 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.63 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -71.26 -49.96 37.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.847 0.356 . . . . 0.0 110.42 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.97 -25.69 58.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.274 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -84.16 -32.46 24.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.502 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.504 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 66.9 m -67.08 -44.78 79.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.008 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.555 ' HA ' HG21 ' A' ' 85' ' ' VAL . 2.5 mp -55.67 -59.64 4.56 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.513 -179.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -49.28 -36.14 19.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.714 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.504 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 19.9 mt-30 -66.07 -57.87 6.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.812 0.339 . . . . 0.0 111.186 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.491 HG23 ' HG2' ' A' ' 50' ' ' GLN . 92.0 mt -53.92 -60.34 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.412 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 59.73 88.45 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.41 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 175.12 172.46 40.06 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.48 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -65.91 -22.48 66.51 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.747 0.308 . . . . 0.0 111.267 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.548 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -63.37 -62.84 1.41 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.472 -179.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.555 HG21 ' HA ' ' A' ' 77' ' ' LEU . 3.4 p -70.85 -21.18 22.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.728 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -50.66 -46.38 58.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.376 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.32 -24.0 26.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.061 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 85' ' ' VAL . . . -71.46 -42.55 68.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.402 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.57 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -71.88 -30.82 65.8 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.446 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.7 -39.27 88.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.649 179.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -77.57 -23.0 50.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.131 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.715 HD22 HD13 ' A' ' 62' ' ' LEU . 1.2 tp -85.99 -26.98 25.14 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.34 -24.09 66.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.412 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -80.29 -26.49 38.88 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.411 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 64.3 p -117.01 20.23 13.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.556 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.488 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -53.7 121.74 19.35 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 115.095 -0.957 . . . . 0.0 113.27 -179.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.8 m -142.67 130.13 21.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.79 0.328 . . . . 0.0 110.835 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 57.84 -129.34 49.39 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.845 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.475 ' O ' HG23 ' A' ' 103' ' ' VAL . 57.2 t80 -70.25 -35.04 73.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.727 0.299 . . . . 0.0 111.204 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.59 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -52.0 -35.96 48.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.049 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.488 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 45.4 ttt180 -72.21 -57.27 4.38 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -48.28 -21.99 0.6 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.122 0.487 . . . . 0.0 110.762 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 99' ' ' PHE . 32.4 t -68.35 -60.4 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.645 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.587 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -54.75 -54.75 37.9 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.502 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 57.4 t -59.02 -61.38 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.586 -178.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -56.1 -37.92 70.05 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -58.73 -29.19 66.51 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.502 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -51.51 -28.96 14.97 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -75.22 6.78 3.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.662 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.5 m -100.22 -61.13 1.41 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.685 0.279 . . . . 0.0 111.465 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.94 -179.749 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.508 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.23 0.064 0 CA-C-O 121.148 0.499 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.535 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.0 t80 -61.76 -40.9 96.76 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.306 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.31 -55.56 34.97 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.469 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.508 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 65.9 Cg_exo -38.16 -29.57 0.14 Allowed 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 122.655 2.237 . . . . 0.0 112.124 178.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.569 HD13 HG13 ' A' ' 46' ' ' ILE . 28.4 mt -66.46 -58.67 4.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.39 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 31' ' ' LEU . 24.3 tp -66.74 -20.18 65.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.201 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -79.35 -34.64 41.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.849 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.53 ' HB3' HG22 ' A' ' 38' ' ' ILE . 75.6 m -65.77 -24.68 66.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.46 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 28' ' ' LEU . 82.5 mt -61.63 -12.06 14.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.791 0.329 . . . . 0.0 110.988 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.5 m -91.13 20.32 5.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.135 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -103.91 138.94 39.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.901 0.381 . . . . 0.0 111.258 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -67.75 -15.53 63.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.679 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.413 ' HB3' HD12 ' A' ' 38' ' ' ILE . 17.1 t70 -76.12 152.18 36.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.107 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 15.5 m0 -95.7 -36.14 11.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.095 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.4 ' HD2' ' O ' ' A' ' 37' ' ' ARG . 5.0 tmm_? -58.85 -38.2 78.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.187 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.53 HG22 ' HB3' ' A' ' 30' ' ' SER . 41.0 mt -75.11 -34.52 31.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.721 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -60.7 -55.85 28.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.276 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.3 -57.12 21.52 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.954 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.73 -36.24 4.87 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.766 0.317 . . . . 0.0 111.509 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.475 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.77 -53.33 57.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.044 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.32 -25.77 63.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.606 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.4 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 7.1 m95 -60.36 -42.54 95.98 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.681 0.622 . . . . 0.0 112.681 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.6 mm -99.35 -23.59 4.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.638 HD13 ' HG2' ' A' ' 57' ' ' PRO . 5.6 tt -59.87 -33.95 54.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -178.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.58 -27.13 69.21 Favored Glycine 0 CA--C 1.518 0.22 0 C-N-CA 120.707 -0.759 . . . . 0.0 113.254 -179.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -70.73 0.72 6.47 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -94.67 -27.41 15.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.66 ' HG3' ' HA ' ' A' ' 80' ' ' ILE . 14.9 mp0 62.35 26.04 15.55 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.234 0.54 . . . . 0.0 110.778 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.407 ' O ' HG23 ' A' ' 55' ' ' VAL . 2.9 m-20 -102.57 166.31 10.59 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.121 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -65.56 -34.83 79.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.16 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.525 ' HG3' HD22 ' A' ' 28' ' ' LEU . 34.2 ttm180 -67.34 -10.02 46.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.56 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -104.82 0.36 28.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.633 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 51' ' ' ASP . 57.4 t -90.69 -50.16 13.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.541 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.549 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.3 tm-20 -58.62 -49.38 93.77 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.958 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.638 ' HG2' HD13 ' A' ' 46' ' ' ILE . 72.8 Cg_exo -49.83 -27.44 15.75 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.32 2.013 . . . . 0.0 112.762 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.666 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 23.4 mt -74.23 -54.1 8.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.097 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.476 ' HA ' HD12 ' A' ' 62' ' ' LEU . 44.7 mm -49.66 -48.21 20.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.875 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -70.02 -30.16 67.4 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 -179.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.639 ' HG ' HG12 ' A' ' 69' ' ' VAL . 4.1 tp -89.82 -17.99 27.09 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.631 HD13 HD22 ' A' ' 92' ' ' LEU . 14.1 mt -70.43 -14.38 62.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.016 0.436 . . . . 0.0 110.828 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -115.12 6.75 15.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.03 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -61.11 -32.21 71.9 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.244 0.545 . . . . 0.0 110.841 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.511 ' HB2' HH21 ' A' ' 70' ' ' ARG . 18.8 t70 55.32 23.72 5.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.066 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.52 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 31.0 t -86.29 -26.01 25.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.84 0.353 . . . . 0.0 110.693 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 125.34 -109.36 1.18 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.485 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.4 ' HD1' ' NE1' ' A' ' 44' ' ' TRP . 0.1 OUTLIER -56.93 -24.33 51.72 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.253 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.639 HG12 ' HG ' ' A' ' 61' ' ' LEU . 39.9 t -68.59 -36.53 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.798 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.511 HH21 ' HB2' ' A' ' 65' ' ' ASP . 19.5 ttm180 -78.45 -51.17 10.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.726 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.1 m -58.02 -37.7 74.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.078 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.09 -51.34 50.87 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.224 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.666 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -67.34 -34.02 76.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.934 0.397 . . . . 0.0 110.703 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.528 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -55.48 -61.58 2.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.952 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -57.17 -27.71 62.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.019 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.425 ' O ' HG13 ' A' ' 80' ' ' ILE . 49.0 m -61.63 -29.92 70.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.76 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.567 HD11 HD11 ' A' ' 62' ' ' LEU . 8.3 mp -55.57 -61.34 2.41 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.711 0.291 . . . . 0.0 111.517 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.43 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 6.1 pt-20 -61.31 -24.99 66.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.997 0.427 . . . . 0.0 110.558 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -70.67 -23.95 62.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.234 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.66 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 91.6 mt -81.83 -60.38 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.571 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . 174.93 -130.94 1.85 Allowed Glycine 0 C--N 1.334 0.433 0 C-N-CA 119.962 -1.113 . . . . 0.0 113.805 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.473 ' H ' ' HD2' ' A' ' 84' ' ' ARG . . . -140.89 -72.89 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.768 -0.729 . . . . 0.0 113.623 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -60.9 -25.5 66.78 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.596 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -86.2 -50.71 6.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.675 0.274 . . . . 0.0 111.038 -179.361 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.538 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -70.84 -20.86 22.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.474 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 68.5 ttt180 -49.57 -30.4 8.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.522 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.42 -32.23 54.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.144 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.14 -51.48 37.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.941 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.511 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 4.1 ppp? -64.19 -25.68 68.18 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.548 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -70.21 -37.83 75.14 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -69.7 -28.91 66.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.476 179.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.631 HD22 HD13 ' A' ' 62' ' ' LEU . 1.4 tp -87.57 -27.53 22.51 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.961 0.41 . . . . 0.0 110.123 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.17 -30.97 71.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.253 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.466 ' HG3' HG23 ' A' ' 95' ' ' THR . 12.1 pt-20 -80.22 -22.99 41.21 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 121.088 0.47 . . . . 0.0 109.758 179.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.466 HG23 ' HG3' ' A' ' 94' ' ' GLU . 52.3 p -108.9 13.16 24.98 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.491 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.79 113.94 4.41 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 114.957 -1.019 . . . . 0.0 113.028 -179.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 39.4 m -140.31 130.09 24.48 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.474 -0.363 . . . . 0.0 110.868 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.69 -126.65 42.56 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.638 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.404 ' O ' HG23 ' A' ' 103' ' ' VAL . 59.5 t80 -73.52 -34.23 65.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.674 0.273 . . . . 0.0 111.263 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.468 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.63 -33.27 54.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.983 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.491 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 29.7 ttt180 -72.39 -56.07 6.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.365 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -48.72 -22.94 0.88 Allowed 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.182 0.515 . . . . 0.0 110.602 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.44 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 33.0 t -67.07 -55.04 19.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.646 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.541 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -61.97 -57.07 13.11 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.564 HG13 ' H ' ' A' ' 106' ' ' ASN . 5.2 p -59.65 -58.65 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.564 ' H ' HG13 ' A' ' 105' ' ' VAL . 4.8 t30 -56.72 -30.12 63.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.709 0.29 . . . . 0.0 111.31 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.51 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 1.2 t80 -58.96 -35.18 72.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.128 0.489 . . . . 0.0 110.308 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.8 mt -53.05 -14.37 0.6 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.898 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.01 6.23 11.95 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.7 p -121.59 -63.49 1.31 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.667 0.27 . . . . 0.0 111.506 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 23.6 p80 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 117.946 -1.026 . . . . 0.0 111.573 -179.784 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.846 0.355 . . . . 0.0 111.415 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.452 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 2.3 t80 -63.42 -45.19 92.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.153 0.501 . . . . 0.0 110.817 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.467 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 7.2 mm-40 -63.41 -56.04 30.34 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.536 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.2 Cg_endo -55.6 -14.52 10.26 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 121.712 1.608 . . . . 0.0 110.643 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.561 HD21 HG13 ' A' ' 46' ' ' ILE . 1.4 tp -86.47 -40.26 15.48 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.373 -1.285 . . . . 0.0 109.212 178.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.586 HD12 HD12 ' A' ' 31' ' ' LEU . 31.8 tp -75.15 -22.49 58.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.297 179.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -69.0 -29.68 67.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.612 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 63.8 m -65.09 -27.71 68.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.41 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.586 HD12 HD12 ' A' ' 28' ' ' LEU . 40.7 mt -65.78 -11.35 45.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.172 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.0 m -100.68 16.38 25.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.645 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -88.93 145.51 25.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -67.79 -27.77 67.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.866 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -75.84 146.21 40.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.933 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 12.2 p90 -87.38 -32.91 19.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.2 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.95 -32.12 73.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.923 0.392 . . . . 0.0 110.37 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.9 mm -81.32 -41.01 18.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.294 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.456 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 40.9 ttm180 -64.06 -48.34 76.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.58 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -57.95 -49.55 73.83 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.791 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.09 -26.98 12.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.642 0.258 . . . . 0.0 111.46 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' O ' HD11 ' A' ' 27' ' ' LEU . . . -62.82 -56.69 15.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.71 0.29 . . . . 0.0 111.049 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.411 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -65.81 -28.84 69.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.049 0.452 . . . . 0.0 110.777 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.2 m95 -57.01 -39.49 74.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.481 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.8 mt -98.35 -25.73 3.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.772 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.561 HG13 HD21 ' A' ' 27' ' ' LEU . 3.5 tt -57.93 -20.99 15.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.361 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.86 -27.56 64.49 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.692 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.548 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.9 OUTLIER -60.29 -30.46 69.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.715 0.293 . . . . 0.0 111.018 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -104.69 106.01 16.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.555 ' HG2' HG23 ' A' ' 80' ' ' ILE . 2.5 mt-30 -66.93 80.0 0.12 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.08 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -128.18 156.72 42.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.006 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.41 -28.58 69.35 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.927 0.394 . . . . 0.0 110.989 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -69.31 -9.52 53.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.757 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.471 ' HB2' HG12 ' A' ' 46' ' ' ILE . . . -104.85 15.4 27.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.62 -179.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 56.5 t -91.55 -58.1 3.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.118 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.485 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 17.5 tt0 -56.49 -48.87 96.29 Favored Pre-proline 0 CA--C 1.531 0.216 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.527 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 86.0 Cg_exo -42.12 -48.1 6.54 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.396 2.064 . . . . 0.0 112.527 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.61 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 7.5 mt -62.13 -44.7 96.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.065 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 50.0 mm -53.66 -58.89 2.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.192 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.46 ' HZ1' ' HB3' ' A' ' 31' ' ' LEU . 3.7 pttt -70.16 -18.93 63.22 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.717 ' HG ' HG12 ' A' ' 69' ' ' VAL . 2.9 tp -89.52 -32.71 17.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.746 HD13 HD11 ' A' ' 92' ' ' LEU . 14.2 mt -64.82 -10.49 28.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.127 0.489 . . . . 0.0 110.381 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -114.26 -2.18 13.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.113 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -61.21 -30.23 70.3 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.134 0.493 . . . . 0.0 111.055 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 54.39 27.15 7.77 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.913 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.504 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.4 t -85.0 -19.36 32.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.943 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 119.86 -110.25 1.78 Allowed Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.48 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -56.92 -26.28 58.95 Favored 'General case' 0 CA--C 1.521 -0.155 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.717 HG12 ' HG ' ' A' ' 61' ' ' LEU . 15.5 t -68.24 -34.11 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.879 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.401 ' NH1' ' HA3' ' A' ' 98' ' ' GLY . 60.1 ttp180 -78.44 -40.85 34.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.838 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 97.3 p -67.03 -38.88 86.7 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.478 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.459 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -53.33 -55.23 25.61 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.6 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.61 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -55.72 -32.72 63.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.786 0.327 . . . . 0.0 111.457 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.432 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.78 -63.89 1.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.581 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 72' ' ' GLY . 0.3 OUTLIER -53.62 -32.64 52.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.341 -179.843 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.457 ' HA ' HE21 ' A' ' 79' ' ' GLN . 17.9 t -56.2 -40.28 73.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 110.865 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.618 HD11 HD11 ' A' ' 62' ' ' LEU . 20.0 mt -62.76 -58.52 7.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -50.4 -35.62 29.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.732 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.457 HE21 ' HA ' ' A' ' 76' ' ' SER . 46.3 mt-30 -62.67 -37.35 86.08 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.068 0.461 . . . . 0.0 110.148 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.555 HG23 ' HG2' ' A' ' 50' ' ' GLN . 95.1 mt -72.8 -60.27 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.792 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 59.49 98.88 0.01 OUTLIER Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.803 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.534 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 172.99 -169.73 42.88 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.617 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -72.03 -30.27 65.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.93 0.395 . . . . 0.0 110.777 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.573 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.1 OUTLIER -59.51 -50.47 73.77 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.004 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.564 HG12 HD23 ' A' ' 77' ' ' LEU . 16.5 m -70.74 -25.35 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.002 0.429 . . . . 0.0 110.739 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.439 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -55.77 -27.92 53.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.466 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.22 -34.64 32.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.755 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.08 -49.47 76.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.891 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.596 ' HE2' ' HA ' ' A' ' 104' ' ' ALA . 3.2 mmm -60.17 -46.79 88.5 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -53.3 -32.56 49.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.071 178.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -73.67 -31.37 63.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.848 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.746 HD11 HD13 ' A' ' 62' ' ' LEU . 25.6 mt -76.53 -38.65 54.76 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.85 0.357 . . . . 0.0 110.606 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.456 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -53.21 -32.45 48.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.068 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -84.82 -19.98 31.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.695 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.8 p -122.41 38.37 4.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.55 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -41.94 117.36 1.26 Allowed Glycine 0 C--N 1.334 0.434 0 CA-C-N 115.741 -0.663 . . . . 0.0 113.353 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.4 t -157.45 136.31 11.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.822 0.344 . . . . 0.0 111.091 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.401 ' HA3' ' NH1' ' A' ' 70' ' ' ARG . . . 60.16 -144.96 46.79 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.417 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -91.81 -14.55 29.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.792 0.33 . . . . 0.0 110.457 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -53.99 -35.64 62.08 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.231 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.456 ' NE ' ' HA ' ' A' ' 93' ' ' ALA . 13.9 tpt180 -67.53 -55.8 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.095 179.078 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -48.53 -28.11 3.16 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.727 178.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.2 t -78.03 -44.51 27.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.805 -1.088 . . . . 0.0 111.343 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.596 ' HA ' ' HE2' ' A' ' 89' ' ' MET . . . -54.89 -57.92 9.68 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -178.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.439 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 42.2 t -61.06 -58.59 6.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.326 -178.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -56.51 -42.8 78.98 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.466 ' OH ' HG21 ' A' ' 85' ' ' VAL . 43.1 t80 -62.03 -28.33 69.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.811 0.339 . . . . 0.0 111.606 -178.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 46.5 mt -58.08 -11.87 2.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.627 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -80.21 4.97 15.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.75 0.309 . . . . 0.0 111.07 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.2 p -140.64 -69.97 0.39 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.207 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.007 -0.996 . . . . 0.0 111.567 179.876 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.494 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.692 0.282 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.524 ' CZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.0 OUTLIER -50.07 -49.78 50.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.315 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.27 -52.55 60.57 Favored Pre-proline 0 N--CA 1.466 0.374 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.822 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.494 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 71.6 Cg_exo -35.03 -34.75 0.1 Allowed 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 122.453 2.102 . . . . 0.0 112.172 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.448 HD13 ' O ' ' A' ' 23' ' ' ALA . 8.4 mp -73.79 -55.3 6.4 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.01 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -50.36 -37.46 37.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.52 178.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -66.62 -32.62 74.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.86 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.7 m -64.92 -13.75 57.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.117 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.471 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 87.7 mt -68.72 -19.81 64.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.897 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 56.7 m -93.36 7.64 43.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.92 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -79.92 128.1 33.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.669 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -58.88 -23.51 61.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.613 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -75.85 149.19 37.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.778 0.323 . . . . 0.0 110.565 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 38.4 p-90 -94.43 -37.95 11.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.442 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -63.69 -42.27 98.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.788 0.328 . . . . 0.0 111.036 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.6 mt -67.56 -44.61 86.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.867 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.471 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.4 ttm180 -63.31 -23.48 67.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.576 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.33 -61.0 6.07 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.48 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.14 -36.31 8.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.733 0.301 . . . . 0.0 111.402 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.418 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.56 -54.71 39.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.906 0.384 . . . . 0.0 110.861 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.4 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -64.8 -30.5 71.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.327 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.3 m95 -70.8 -31.2 67.88 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 61.7 mt -99.6 -27.02 3.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.873 0.368 . . . . 0.0 111.648 -178.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.683 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.1 tt -60.85 -28.88 44.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.699 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.543 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -69.89 -4.06 46.13 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.937 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.498 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.9 OUTLIER -69.82 -40.22 76.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.755 0.312 . . . . 0.0 110.196 179.346 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.465 ' C ' ' H ' ' A' ' 51' ' ' ASP . 11.9 m-85 -91.33 119.42 31.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.738 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.459 ' HA ' HD12 ' A' ' 80' ' ' ILE . 1.9 mt-30 -72.78 25.85 0.06 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.48 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.465 ' H ' ' C ' ' A' ' 49' ' ' PHE . 29.2 t70 -83.98 155.33 22.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.908 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -59.07 -33.0 70.29 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.329 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -67.63 -11.96 59.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.865 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.641 ' O ' HD13 ' A' ' 58' ' ' LEU . . . -105.91 -8.45 17.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.036 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 59' ' ' ILE . 96.4 t -91.52 -30.16 4.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.418 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.557 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 17.3 tt0 -60.27 -50.52 85.57 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.683 ' HG2' HD13 ' A' ' 46' ' ' ILE . 74.5 Cg_exo -49.32 -52.37 8.91 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.924 1.75 . . . . 0.0 111.859 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.687 HD23 ' HG ' ' A' ' 77' ' ' LEU . 5.1 mp -56.04 -27.17 52.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.881 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 55' ' ' VAL . 40.4 mm -63.35 -59.54 4.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.739 0.304 . . . . 0.0 111.379 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -70.04 -22.79 63.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.521 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.747 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -65.37 -51.94 57.04 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.941 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.772 HD13 HD22 ' A' ' 92' ' ' LEU . 9.1 mt -51.93 -21.58 3.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.351 . . . . 0.0 111.304 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -104.24 -18.36 14.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.107 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.414 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 8.3 t0 -59.65 -36.06 75.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 111.144 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.482 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 24.7 t70 52.19 30.28 7.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.229 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.488 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.3 t -80.07 -3.07 47.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.217 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.87 -81.56 1.6 Allowed Glycine 0 C--O 1.228 -0.238 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.944 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.64 -47.15 82.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.2 0.524 . . . . 0.0 109.649 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.747 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.2 t -69.04 -45.44 80.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.46 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.482 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 7.0 tmm_? -64.32 -62.45 1.6 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.873 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.7 m -54.07 -30.14 47.01 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.975 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.72 -39.85 94.13 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.41 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.403 ' HA ' ' HG ' ' A' ' 58' ' ' LEU . . . -67.9 -38.85 83.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.638 0.256 . . . . 0.0 111.363 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.63 -54.23 24.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.3 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.436 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 4.0 ptp180 -67.96 -42.94 80.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.002 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.543 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 74.6 m -59.21 -31.06 68.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.742 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.695 HD22 HG13 ' A' ' 85' ' ' VAL . 69.6 mt -70.67 -60.46 2.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.975 -179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -59.87 -22.51 62.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.147 0.499 . . . . 0.0 110.293 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.436 ' HB2' ' O ' ' A' ' 75' ' ' ARG . 7.6 tt0 -56.9 -37.49 71.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.56 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.459 HD12 ' HA ' ' A' ' 50' ' ' GLN . 32.2 mm -71.56 -60.22 2.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.963 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.44 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 69.45 80.31 0.26 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.296 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -176.69 179.1 47.85 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.391 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -63.44 -22.39 66.86 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.823 0.345 . . . . 0.0 110.971 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.56 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -62.07 -59.88 4.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.355 -179.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.695 HG13 HD22 ' A' ' 77' ' ' LEU . 74.8 t -69.64 -24.09 26.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.94 0.4 . . . . 0.0 110.638 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.427 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 2.7 tmt_? -56.65 -27.44 58.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.072 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -82.67 -31.8 28.46 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.769 0.319 . . . . 0.0 111.079 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.79 -34.51 75.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.422 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.57 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 7.0 mmt -71.17 -47.57 56.91 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.414 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -57.74 -29.85 65.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.031 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -80.07 -32.7 39.29 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.935 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.772 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -80.81 -26.08 37.37 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.022 0.439 . . . . 0.0 109.847 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.02 -21.67 65.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.526 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -80.22 -27.21 38.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.675 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.1 p -118.44 24.27 11.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.387 178.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.43 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -56.85 119.65 16.59 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.549 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.4 t -144.58 130.4 19.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.836 0.351 . . . . 0.0 110.894 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.44 -130.08 11.84 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.824 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -87.0 -26.51 23.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.571 0.225 . . . . 0.0 111.267 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.652 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.42 -37.49 62.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.859 0.362 . . . . 0.0 111.5 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.43 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 35.4 ttp180 -66.56 -58.46 5.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.707 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 57.9 tttp -46.23 -24.31 0.45 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.191 0.52 . . . . 0.0 110.79 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 45.2 t -71.93 -59.74 3.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.634 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.738 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -56.34 -51.79 66.95 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 15.5 t -62.27 -63.74 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -55.36 -39.3 69.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.57 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 31.0 t80 -61.57 -31.73 71.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 120.808 0.337 . . . . 0.0 111.441 -178.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 58.5 mt -57.38 -12.19 2.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.61 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.86 -12.2 60.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.865 0.364 . . . . 0.0 110.993 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 73.0 p -113.7 -62.62 1.57 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.309 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.152 -0.927 . . . . 0.0 110.805 -179.971 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.509 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.458 -0.054 0 CA-C-O 120.605 0.24 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.4 t80 -60.61 -48.59 81.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.969 0.414 . . . . 0.0 110.243 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.406 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 18.9 mt-10 -63.45 -56.99 22.03 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.965 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.509 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 88.0 Cg_exo -43.04 -28.82 1.38 Allowed 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.365 2.043 . . . . 0.0 111.624 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 65.3 mt -68.76 -55.02 12.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.298 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.554 HD12 HD12 ' A' ' 31' ' ' LEU . 18.7 tp -67.88 -18.82 64.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.513 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -79.04 -42.8 25.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.964 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.1 p -66.48 -13.7 61.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.395 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.554 HD12 HD12 ' A' ' 28' ' ' LEU . 87.3 mt -67.51 -7.4 25.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.244 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.8 p -95.7 15.33 20.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.561 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -95.01 136.93 34.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -67.3 -1.87 5.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.025 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -84.59 153.24 23.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.77 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.4 p-90 -104.43 -38.64 6.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.954 0.407 . . . . 0.0 110.53 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.454 ' HG3' HG13 ' A' ' 38' ' ' ILE . 13.7 ptm180 -62.82 -39.03 93.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.79 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.454 HG13 ' HG3' ' A' ' 37' ' ' ARG . 50.8 mt -79.36 -47.99 21.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.934 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.488 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 38.3 ttm180 -63.5 -28.51 70.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.601 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.69 -59.02 6.37 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.423 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.14 -29.63 22.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.741 0.305 . . . . 0.0 110.976 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.67 -55.49 23.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.479 ' O ' HG22 ' A' ' 46' ' ' ILE . . . -69.48 -22.89 63.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.193 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.1 m95 -66.12 -28.31 68.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.614 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.8 mt -99.6 -23.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.71 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.479 HG22 ' O ' ' A' ' 43' ' ' ALA . 0.6 OUTLIER -61.08 -32.69 53.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.503 -179.248 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.62 -16.58 63.52 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.552 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.556 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.9 OUTLIER -68.97 -27.04 65.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.837 0.351 . . . . 0.0 110.681 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -99.05 112.77 24.81 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.801 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.745 ' H ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -77.98 36.58 0.23 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.817 179.473 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.416 ' O ' HG23 ' A' ' 55' ' ' VAL . 33.9 t70 -95.37 165.53 12.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.992 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.48 -31.31 72.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.518 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.444 ' HB3' ' CE2' ' A' ' 24' ' ' PHE . 41.5 ttm180 -69.17 -14.15 62.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.425 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.37 5.19 31.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.031 0.444 . . . . 0.0 110.641 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.651 ' HA ' ' NH2' ' A' ' 84' ' ' ARG . 98.9 t -87.03 -46.9 16.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.804 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.466 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 34.2 tt0 -60.34 -48.25 94.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.466 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 81.0 Cg_exo -42.14 -52.09 4.36 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.405 2.07 . . . . 0.0 112.817 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 73' ' ' ALA . 6.8 mt -60.62 -37.0 79.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.333 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.9 mm -55.21 -59.43 2.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.477 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.19 -15.77 62.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.24 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.788 HD23 ' H ' ' A' ' 73' ' ' ALA . 0.4 OUTLIER -74.14 -52.66 11.85 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -178.892 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.52 HD13 HD22 ' A' ' 92' ' ' LEU . 7.9 mt -57.06 -10.34 1.12 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.306 -179.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -111.99 -13.44 13.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.618 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.413 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 52.8 m-20 -61.14 -32.23 71.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.799 0.333 . . . . 0.0 111.78 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.511 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 32.9 m-20 48.26 32.12 2.98 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.07 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.47 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 29.3 t -83.07 -24.42 32.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.494 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.43 -85.39 0.39 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.95 -0.643 . . . . 0.0 111.556 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.89 -42.43 99.77 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.679 HG12 ' HG ' ' A' ' 61' ' ' LEU . 13.6 t -69.33 -56.86 10.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.056 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.511 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 7.3 tmm_? -54.67 -51.65 64.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.544 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.6 m -63.96 -19.92 65.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.377 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.49 -65.12 3.65 Favored Glycine 0 C--O 1.228 -0.222 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.572 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.788 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -49.77 -31.23 11.06 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.63 -46.54 73.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.788 0.328 . . . . 0.0 111.35 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 6.8 ptp180 -82.23 -24.45 34.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.853 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.542 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 49.6 m -63.52 -38.94 93.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.512 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.6 mt -58.92 -59.96 4.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.137 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.458 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 38.8 mt-10 -46.23 -32.67 3.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.132 179.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.542 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 20.6 mt-30 -70.81 -41.5 71.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.348 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.499 HD13 ' HE ' ' A' ' 84' ' ' ARG . 59.9 mt -75.28 -61.43 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.86 -179.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.64 168.51 2.36 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.673 -0.775 . . . . 0.0 113.006 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.58 -170.59 24.4 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.895 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -64.89 -24.48 67.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.156 0.503 . . . . 0.0 110.419 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.651 ' NH2' ' HA ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER -54.83 -62.37 1.7 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.63 179.719 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.528 HG21 ' OH ' ' A' ' 107' ' ' TYR . 16.1 m -63.22 -24.75 36.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.27 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.534 ' HA ' ' HE1' ' A' ' 89' ' ' MET . 0.2 OUTLIER -54.62 -33.36 60.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.366 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.21 -24.27 24.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.713 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.43 ' HB2' ' NH1' ' A' ' 84' ' ' ARG . . . -70.27 -49.06 53.72 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.534 ' HE1' ' HA ' ' A' ' 86' ' ' ARG . 0.7 OUTLIER -70.18 -30.51 67.65 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.639 0.257 . . . . 0.0 110.888 -179.14 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -69.8 -43.4 72.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.7 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -67.91 -28.99 67.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.716 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.52 HD22 HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -86.33 -27.84 24.06 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.999 179.702 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.9 -22.91 65.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.578 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -80.23 -26.67 38.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.494 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 59.8 p -122.65 23.58 9.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.374 0.606 . . . . 0.0 109.471 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.559 ' HA3' ' HG2' ' A' ' 101' ' ' ARG . . . -58.31 124.94 38.02 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 115.036 -0.984 . . . . 0.0 113.128 -179.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.412 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 2.3 t -141.23 130.15 23.13 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.72 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 62.63 -140.18 45.85 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.406 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.483 ' O ' HG23 ' A' ' 103' ' ' VAL . 62.2 t80 -62.07 -35.5 78.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.758 0.313 . . . . 0.0 110.66 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.504 ' HB2' ' HD3' ' A' ' 70' ' ' ARG . . . -54.44 -36.53 64.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.253 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.559 ' HG2' ' HA3' ' A' ' 96' ' ' GLY . 1.3 tmt_? -68.83 -61.78 1.66 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.466 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -52.11 -22.53 4.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.295 -179.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 99' ' ' PHE . 5.1 t -67.07 -53.15 36.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.536 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.453 ' O ' HD23 ' A' ' 108' ' ' LEU . . . -54.81 -62.61 1.54 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.068 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.5 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 23.5 t -54.78 -57.67 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.397 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.14 -32.5 66.43 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.528 ' OH ' HG21 ' A' ' 85' ' ' VAL . 34.9 t80 -63.3 -25.35 68.27 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 120.759 0.314 . . . . 0.0 111.161 -178.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.8 mm? -50.91 -26.89 6.46 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.01 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -53.91 -13.58 0.79 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.36 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 34.7 p -119.75 -87.49 0.64 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.305 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.418 ' HB2' HG21 ' A' ' 85' ' ' VAL . 15.7 m-70 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.952 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.895 0.378 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 51' ' ' ASP . 0.4 OUTLIER -52.62 -48.27 66.47 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.021 179.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.526 ' HG3' ' NH1' ' A' ' 53' ' ' ARG . 3.6 mt-10 -62.21 -57.02 25.68 Favored Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 1.9 Cg_endo -50.72 -19.18 4.85 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.996 1.797 . . . . 0.0 111.498 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.505 HD21 ' HA ' ' A' ' 46' ' ' ILE . 0.8 OUTLIER -81.63 -39.91 23.72 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.697 179.367 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 31' ' ' LEU . 10.8 tp -80.26 -22.15 41.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.364 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -73.95 -34.63 64.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.626 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.0 m -66.17 -17.19 64.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.12 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 28' ' ' LEU . 51.3 mt -68.23 -6.59 24.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.862 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.1 m -103.19 11.24 37.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.758 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -71.1 142.15 50.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.821 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -59.51 -34.53 72.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.346 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -81.4 144.33 31.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.973 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.1 p90 -87.3 -32.8 19.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.016 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -58.77 -35.62 73.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.468 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.2 mm -80.83 -41.4 19.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.492 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.531 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 29.5 ttm180 -63.26 -20.02 65.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.629 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.81 -62.88 3.58 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.707 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.62 -33.04 2.64 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.644 0.259 . . . . 0.0 111.438 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.438 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.02 -52.75 63.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.916 0.389 . . . . 0.0 110.085 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.496 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -64.47 -28.71 69.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.74 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -66.97 -36.69 82.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.124 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.1 mm -99.29 -22.29 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.505 ' HA ' HD21 ' A' ' 27' ' ' LEU . 4.2 tt -61.04 -38.94 80.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -178.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.75 -6.59 17.87 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.256 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.595 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER -70.59 -49.77 44.22 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.514 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -65.69 -26.81 67.94 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.508 ' HG2' HG12 ' A' ' 80' ' ' ILE . 2.0 mt-30 61.07 16.29 6.97 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.783 0.325 . . . . 0.0 111.4 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 55' ' ' VAL . 18.9 t70 -84.11 -178.72 7.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.033 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -61.54 -37.24 83.06 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -179.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.609 ' HB3' HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -67.19 -10.6 52.14 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.888 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.98 -9.42 17.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.975 0.417 . . . . 0.0 111.273 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 51' ' ' ASP . 62.5 t -82.02 -47.88 18.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.934 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.481 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 4.7 tp10 -60.1 -48.31 94.76 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.5 ' HG2' HD13 ' A' ' 46' ' ' ILE . 83.9 Cg_exo -43.0 -53.07 4.26 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.289 1.993 . . . . 0.0 112.664 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.613 HD13 HD22 ' A' ' 77' ' ' LEU . 16.3 mt -53.54 -34.22 57.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.046 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 42.9 mm -63.29 -61.15 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.503 ' HG3' HD13 ' A' ' 61' ' ' LEU . 16.8 pttt -72.19 -19.09 61.8 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.675 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -77.77 -51.1 11.07 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.617 HD11 HD21 ' A' ' 77' ' ' LEU . 69.4 mt -63.43 -9.01 10.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.225 0.536 . . . . 0.0 109.972 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -112.94 -16.23 12.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.478 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.459 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.9 OUTLIER -61.09 -54.44 44.61 Favored 'General case' 0 CA--C 1.517 -0.288 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.307 -179.571 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 12.5 t70 72.02 25.5 3.02 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.738 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 69.0 m -81.21 -4.92 57.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.993 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.53 -101.84 2.45 Favored Glycine 0 C--O 1.229 -0.193 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.656 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.16 -30.46 37.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.262 0.553 . . . . 0.0 109.928 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.675 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.0 t -73.6 -46.83 46.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.198 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -70.46 -60.51 2.22 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.686 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.6 m -54.16 -28.34 39.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.872 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.88 -37.74 94.85 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.447 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.421 ' O ' HD23 ' A' ' 77' ' ' LEU . . . -79.8 -37.08 36.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.653 0.263 . . . . 0.0 110.987 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -46.26 -35.06 4.89 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.157 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.416 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 1.2 ptp85 -83.91 -33.51 24.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.652 0.263 . . . . 0.0 111.453 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.483 ' HA ' HE21 ' A' ' 79' ' ' GLN . 66.4 m -57.84 -37.43 73.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.891 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.617 HD21 HD11 ' A' ' 62' ' ' LEU . 4.1 mm? -55.33 -61.22 2.48 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 110.95 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -65.25 -24.69 67.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.677 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.483 HE21 ' HA ' ' A' ' 76' ' ' SER . 3.2 tt0 -60.89 -58.49 8.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.8 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.607 HD12 HG13 ' A' ' 85' ' ' VAL . 95.4 mt -63.29 -52.02 63.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.101 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 55.39 76.43 0.19 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.663 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -174.68 -179.76 45.48 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.598 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -59.64 -21.48 60.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.951 0.405 . . . . 0.0 110.699 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.612 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 1.2 mpt_? -59.7 -64.33 0.98 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.333 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.607 HG13 HD12 ' A' ' 80' ' ' ILE . 0.0 OUTLIER -70.84 -20.59 22.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.931 179.351 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -52.88 -33.09 48.42 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.933 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.55 -26.34 35.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.441 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.17 -45.0 64.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.008 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.556 ' HE3' ' HG2' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -68.88 -29.77 68.13 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.488 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.556 ' HG2' ' HE3' ' A' ' 89' ' ' MET . 10.1 mm-40 -70.82 -31.32 68.01 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.077 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -74.45 -31.4 62.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.191 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.56 HD21 ' O ' ' A' ' 100' ' ' ALA . 1.7 tp -86.55 -32.23 20.81 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.776 0.322 . . . . 0.0 110.172 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -54.91 -28.06 47.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.162 0.506 . . . . 0.0 110.265 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -83.21 -25.46 31.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.205 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 54.2 p -116.12 32.08 6.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.008 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.565 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -46.51 121.41 5.66 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.307 -0.86 . . . . 0.0 113.771 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.0 m -150.47 130.71 13.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.777 0.322 . . . . 0.0 110.403 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.9 -139.72 28.97 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.348 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -89.6 -18.48 26.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.824 0.345 . . . . 0.0 110.367 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.604 ' HB1' ' HB3' ' A' ' 62' ' ' LEU . . . -54.18 -43.96 71.14 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.594 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.565 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 55.4 ttp180 -51.84 -57.95 7.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.31 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -56.55 -32.15 64.86 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.094 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.56 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 18.9 t -64.14 -41.83 93.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.227 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.516 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -64.51 -57.18 9.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.056 0.455 . . . . 0.0 111.872 -179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.523 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 6.3 p -64.93 -54.26 31.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.879 -178.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.516 ' N ' HG13 ' A' ' 105' ' ' VAL . 5.1 t30 -55.55 -34.36 64.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.588 0.232 . . . . 0.0 111.404 -179.123 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.449 ' OH ' HG23 ' A' ' 85' ' ' VAL . 5.6 t80 -58.83 -31.68 68.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.46 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.523 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -49.96 -20.29 0.89 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.53 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -69.08 5.06 1.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.449 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.8 m -108.48 -72.51 0.72 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.711 0.291 . . . . 0.0 111.329 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 84.4 t60 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.735 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.586 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.183 0 CA-C-O 120.922 0.392 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.3 t80 -62.26 -40.43 96.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 121.315 0.578 . . . . 0.0 109.526 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.513 ' HG2' ' NH1' ' A' ' 53' ' ' ARG . 43.2 mt-10 -63.41 -56.2 28.92 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.881 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.586 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 77.2 Cg_exo -37.2 -29.23 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.24 0 C-N-CA 122.639 2.226 . . . . 0.0 111.695 179.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 81.7 mt -72.68 -58.41 3.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.588 178.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.544 ' HA ' HD12 ' A' ' 31' ' ' LEU . 49.1 tp -61.27 -24.88 66.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.783 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -79.1 -44.6 21.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.765 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.5 p -65.54 -11.73 46.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.0 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.547 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 43.5 mt -70.21 -6.84 37.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.129 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 77.7 p -111.98 13.89 20.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.776 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.726 HD21 ' HB2' ' A' ' 35' ' ' ASP . 0.8 OUTLIER -69.09 147.67 51.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.017 179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -56.82 -44.12 81.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.395 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.726 ' HB2' HD21 ' A' ' 33' ' ' ASN . 10.9 m-20 -75.85 163.27 27.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.055 0.455 . . . . 0.0 111.388 -179.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -103.72 -29.59 10.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.737 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -63.53 -32.97 74.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.218 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.3 mt -81.16 -41.8 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.847 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.547 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 32.7 ttm180 -61.75 -29.8 70.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.724 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -56.11 -63.25 5.48 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.348 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.27 -29.28 9.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.545 0.212 . . . . 0.0 111.479 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.56 -52.08 59.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.873 0.368 . . . . 0.0 110.531 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.431 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -67.01 -31.35 71.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.687 179.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -70.7 -28.29 64.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.254 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 81.2 mt -98.76 -27.99 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.841 0.353 . . . . 0.0 111.655 -179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.594 HD13 ' HG2' ' A' ' 57' ' ' PRO . 1.5 tt -60.31 -30.36 46.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.827 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.42 -20.8 63.81 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.939 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -65.79 -23.85 66.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.846 0.355 . . . . 0.0 110.445 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.489 ' C ' ' H ' ' A' ' 51' ' ' ASP . 9.1 m-85 -95.29 109.5 21.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.486 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -71.85 16.66 0.11 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.3 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.489 ' H ' ' C ' ' A' ' 49' ' ' PHE . 37.1 t70 -84.04 161.56 20.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.641 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.91 -28.7 69.13 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.552 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.513 ' NH1' ' HG2' ' A' ' 25' ' ' GLU . 12.7 ttm180 -63.91 -13.95 49.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.024 0.44 . . . . 0.0 110.489 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.19 -10.61 16.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.486 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.429 HG13 ' HB2' ' A' ' 88' ' ' ALA . 68.2 t -82.23 -36.11 13.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.625 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.559 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 3.8 tp10 -60.37 -49.97 87.96 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.274 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.594 ' HG2' HD13 ' A' ' 46' ' ' ILE . 82.8 Cg_exo -45.14 -51.27 7.89 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.287 1.991 . . . . 0.0 111.892 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.754 HD13 HD22 ' A' ' 77' ' ' LEU . 4.8 mt -54.73 -35.04 63.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.624 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.558 HG23 ' HD2' ' A' ' 91' ' ' LYS . 46.2 mm -60.77 -60.76 2.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.822 0.344 . . . . 0.0 111.566 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -71.48 -10.85 60.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.103 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.75 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.7 mp -88.62 -48.05 7.83 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.692 HD13 HD22 ' A' ' 92' ' ' LEU . 26.5 mt -60.32 -12.31 8.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.971 0.415 . . . . 0.0 110.798 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -113.93 -11.97 12.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.816 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -61.12 -44.95 96.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.101 0.477 . . . . 0.0 111.089 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.63 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 28.5 m-20 66.93 22.22 10.17 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.944 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.513 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 39.6 m -86.38 16.06 4.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.637 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.08 -100.27 0.84 Allowed Glycine 0 C--O 1.227 -0.319 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.857 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -46.86 -40.97 14.97 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.076 0.465 . . . . 0.0 110.741 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.75 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.4 t -71.26 -51.11 36.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.45 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.63 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 53.7 ttp180 -62.3 -60.64 3.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.22 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 88.5 p -53.98 -34.13 58.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.993 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.48 -26.71 57.31 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.056 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.5 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -88.12 -39.77 14.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.787 0.327 . . . . 0.0 110.878 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.07 -34.99 59.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.099 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -80.66 -23.97 39.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.937 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.676 ' HA ' HE21 ' A' ' 79' ' ' GLN . 74.6 m -67.07 -39.07 86.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.291 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.754 HD22 HD13 ' A' ' 58' ' ' LEU . 4.2 mm? -55.36 -57.02 13.58 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.826 0.345 . . . . 0.0 110.565 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.91 -34.75 78.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.363 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.676 HE21 ' HA ' ' A' ' 76' ' ' SER . 0.2 OUTLIER -56.37 -44.61 80.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.254 -179.713 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.409 HD12 ' CG1' ' A' ' 85' ' ' VAL . 92.2 mt -78.22 -59.73 2.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.853 0.359 . . . . 0.0 110.752 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.61 97.77 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.599 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.437 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 170.16 -177.48 43.44 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.484 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -68.83 -30.97 69.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.572 0.225 . . . . 0.0 110.972 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.538 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.57 -53.22 60.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.821 0.343 . . . . 0.0 110.438 179.732 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.538 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -70.82 -24.07 24.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.267 179.311 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.444 HH11 ' HD2' ' A' ' 86' ' ' ARG . 18.1 ttt180 -58.84 -38.09 77.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.419 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.32 -22.86 59.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.757 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.429 ' HB2' HG13 ' A' ' 55' ' ' VAL . . . -71.52 -46.83 58.54 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.993 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.603 ' HE2' ' HB3' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -72.23 -32.69 66.94 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.6 179.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.534 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 27.1 mt-10 -59.16 -41.46 88.44 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 179.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.558 ' HD2' HG23 ' A' ' 59' ' ' ILE . 9.3 tmtm? -64.49 -23.6 67.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.636 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.692 HD22 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -87.1 -28.37 22.56 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.881 179.223 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.26 -30.97 72.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.317 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.476 ' HG3' HG23 ' A' ' 95' ' ' THR . 13.5 pt-20 -80.15 -18.63 49.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.967 0.413 . . . . 0.0 110.366 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.476 HG23 ' HG3' ' A' ' 94' ' ' GLU . 51.2 p -123.98 25.53 7.9 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -65.89 127.01 30.12 Favored Glycine 0 N--CA 1.443 -0.871 0 CA-C-N 115.011 -0.995 . . . . 0.0 113.343 -178.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.1 t -141.92 131.83 24.44 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.27 -0.465 . . . . 0.0 111.138 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.02 -127.13 42.33 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.821 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -66.46 -40.02 89.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.596 0.236 . . . . 0.0 111.058 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.53 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -50.67 -41.17 55.25 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.605 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.424 ' CD ' ' HA3' ' A' ' 96' ' ' GLY . 7.9 tpt180 -64.33 -59.11 4.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.092 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -50.02 -23.27 1.95 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.146 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.53 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 13.6 t -66.45 -60.27 2.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.587 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.26 -53.23 60.41 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.524 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 10.2 p -60.79 -50.07 82.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.52 ' N ' HG13 ' A' ' 105' ' ' VAL . 58.1 t30 -70.75 -30.67 67.25 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.439 ' HD2' ' HG2' ' A' ' 89' ' ' MET . 7.4 t80 -64.56 -49.07 72.67 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -177.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.603 ' HB3' ' HE2' ' A' ' 89' ' ' MET . 3.8 pp -55.03 -12.14 0.8 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.238 -178.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -65.87 -30.27 70.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.917 0.389 . . . . 0.0 110.692 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 22.0 p -112.61 -42.24 3.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.161 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 29.9 p80 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.529 -0.748 . . . . 0.0 111.488 179.74 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.704 ' O ' HD23 ' A' ' 27' ' ' LEU . . . . . . . . 0 N--CA 1.453 -0.318 0 CA-C-O 120.455 0.169 . . . . 0.0 111.392 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.507 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 5.6 t80 -41.96 -55.91 2.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.42 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.41 -58.77 14.11 Favored Pre-proline 0 C--N 1.324 -0.507 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.485 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.553 ' HA ' ' HB2' ' A' ' 29' ' ' GLU . 66.9 Cg_exo -40.51 -36.5 1.78 Allowed 'Trans proline' 0 C--N 1.361 1.217 0 C-N-CA 122.622 2.214 . . . . 0.0 112.462 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.704 HD23 ' O ' ' A' ' 23' ' ' ALA . 3.8 mm? -53.03 -57.06 11.66 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.115 0.483 . . . . 0.0 110.282 178.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.497 HD12 HD12 ' A' ' 31' ' ' LEU . 1.1 tp -74.3 -31.51 62.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.693 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 26' ' ' PRO . 43.2 mt-10 -64.53 -29.77 70.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.584 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.0 t -66.38 -17.35 64.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.226 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.497 HD12 HD12 ' A' ' 28' ' ' LEU . 86.9 mt -67.53 -6.38 19.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 110.741 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.4 p -121.95 21.52 10.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -86.02 149.07 25.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.892 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.65 -31.75 73.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.368 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -82.54 163.3 21.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.734 0.302 . . . . 0.0 110.918 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -110.89 -41.75 4.17 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.476 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -58.9 -29.44 67.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.05 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.14 -42.86 27.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.718 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.465 ' HD2' HG21 ' A' ' 69' ' ' VAL . 33.7 ttm180 -61.99 -20.45 63.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.305 179.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.89 -66.26 2.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.282 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.69 -28.27 5.77 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.693 0.282 . . . . 0.0 111.216 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.515 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -62.57 -56.99 12.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.498 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.68 -31.54 72.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.785 179.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -70.87 -34.31 71.49 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.784 -178.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.4 mt -99.24 -21.22 5.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.851 0.358 . . . . 0.0 111.852 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.536 HD13 ' HG2' ' A' ' 57' ' ' PRO . 7.0 tt -61.06 -33.41 55.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -69.51 -22.46 76.53 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.663 -0.78 . . . . 0.0 113.152 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -70.81 -10.95 60.58 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -84.57 -34.82 23.13 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.696 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.3 OUTLIER 59.74 47.09 10.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.977 0.418 . . . . 0.0 110.952 -179.67 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.482 ' O ' HG23 ' A' ' 55' ' ' VAL . 10.8 t70 -127.5 178.84 5.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.19 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -60.81 -43.89 97.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.99 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.445 HH11 HD23 ' A' ' 28' ' ' LEU . 15.6 mmt180 -64.47 -10.81 27.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.724 0.297 . . . . 0.0 111.224 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.23 5.47 32.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.642 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 51' ' ' ASP . 94.6 t -90.7 -55.65 6.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.123 -179.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.469 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 31.9 tt0 -57.64 -48.87 96.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.536 ' HG2' HD13 ' A' ' 46' ' ' ILE . 80.2 Cg_exo -42.64 -53.3 3.91 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.379 2.053 . . . . 0.0 112.619 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.547 HD13 HD22 ' A' ' 77' ' ' LEU . 12.3 mt -54.27 -38.77 66.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.71 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 51.0 mm -60.71 -60.2 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -70.1 -7.78 44.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.89 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.764 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.0 OUTLIER -89.49 -42.85 11.23 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.507 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.602 HD13 HD22 ' A' ' 92' ' ' LEU . 8.1 mt -62.13 -9.36 7.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.257 0.551 . . . . 0.0 110.256 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -123.82 -4.79 8.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.635 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.53 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 25.5 t0 -61.06 -29.16 69.57 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.148 0.499 . . . . 0.0 111.107 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.679 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 12.3 t70 55.13 26.24 8.03 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.473 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.509 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 45.9 t -86.28 -3.38 58.97 Favored 'General case' 0 C--N 1.334 -0.104 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.127 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.12 -70.87 2.71 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.867 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.99 -54.53 14.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.216 0.532 . . . . 0.0 109.636 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.764 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.5 t -68.86 -30.31 46.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.272 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.679 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 41.7 ttt180 -71.45 -63.29 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.819 0.342 . . . . 0.0 111.079 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.5 m -61.81 -21.29 64.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.269 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -65.19 -22.17 68.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.341 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.427 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -88.46 -49.85 6.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -44.16 -32.63 1.28 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.727 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' A' ' 75' ' ' ARG . 6.2 ptp180 -79.75 -34.18 40.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 0.0 110.969 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.455 ' HB2' HD22 ' A' ' 58' ' ' LEU . 70.9 m -63.77 -35.99 82.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.453 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.547 HD22 HD13 ' A' ' 58' ' ' LEU . 3.9 mm? -55.46 -59.13 5.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.836 0.35 . . . . 0.0 110.318 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.464 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 34.3 tt0 -63.6 -26.37 68.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.948 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.416 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 8.2 mt-30 -62.32 -51.2 68.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.63 179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.696 HG12 ' HG3' ' A' ' 50' ' ' GLN . 69.0 mt -65.73 -55.59 18.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.681 179.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.78 116.67 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.716 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 149.5 177.34 23.5 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.431 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -63.11 -22.41 66.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.815 0.34 . . . . 0.0 110.976 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.534 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -63.09 -58.76 6.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.388 -179.811 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.471 ' H ' ' HG2' ' A' ' 84' ' ' ARG . 4.2 m -70.48 -22.93 24.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.927 0.394 . . . . 0.0 111.288 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -58.71 -35.16 72.21 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.944 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.71 -29.05 67.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.287 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.7 70.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.691 179.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.59 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 17.7 mmm -68.51 -51.72 39.98 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.38 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -54.95 -35.96 64.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.904 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.6 tmtm? -77.73 -25.91 49.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.491 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.602 HD22 HD13 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -86.59 -21.56 26.75 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.156 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.73 -21.13 59.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.725 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -80.35 -24.79 39.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.286 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 81.4 p -122.55 14.82 10.28 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.434 ' C ' ' HB2' ' A' ' 101' ' ' ARG . . . -61.24 128.27 43.88 Favored Glycine 0 N--CA 1.444 -0.782 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.989 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.491 HG23 HH22 ' A' ' 70' ' ' ARG . 4.3 t -139.82 130.16 25.38 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.916 0.389 . . . . 0.0 111.169 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.06 -108.84 2.44 Favored Glycine 0 CA--C 1.519 0.302 0 C-N-CA 121.113 -0.565 . . . . 0.0 113.282 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 103' ' ' VAL . 53.3 t80 -85.6 -40.35 16.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.655 0.264 . . . . 0.0 111.541 -179.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.454 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -48.43 -38.1 18.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 112.059 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.434 ' HB2' ' C ' ' A' ' 96' ' ' GLY . 42.5 ttt180 -73.82 -56.49 4.91 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.492 ' HG3' ' ND2' ' A' ' 106' ' ' ASN . 2.2 tpmt? -46.67 -21.71 0.22 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.179 0.514 . . . . 0.0 110.813 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 99' ' ' PHE . 37.5 t -74.49 -59.69 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.912 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.534 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.37 -44.48 84.44 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.406 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 51.7 t -63.9 -64.07 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -177.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.492 ' ND2' ' HG3' ' A' ' 102' ' ' LYS . 91.8 m-20 -60.21 -37.57 80.7 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.59 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 24.8 t80 -60.74 -32.42 71.7 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 120.789 0.328 . . . . 0.0 111.074 -178.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 35.6 mt -54.19 -18.24 3.63 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.534 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -71.94 1.62 6.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.099 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 18.9 m -114.24 -80.09 0.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.187 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 61.0 m80 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.948 -179.966 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.512 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.144 0 CA-C-O 120.939 0.399 . . . . 0.0 110.702 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.478 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 11.7 t80 -54.71 -59.98 3.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.342 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.41 -55.56 34.38 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.106 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.512 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 98.5 Cg_exo -42.43 -31.66 1.93 Allowed 'Trans proline' 0 C--N 1.36 1.174 0 C-N-CA 122.298 1.998 . . . . 0.0 111.74 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.481 ' HB2' HH12 ' A' ' 53' ' ' ARG . 33.5 mt -67.91 -58.62 4.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.305 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.595 HD12 HD12 ' A' ' 31' ' ' LEU . 13.7 tp -62.06 -21.92 65.33 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.376 179.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -77.2 -27.47 53.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.634 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.468 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 74.1 m -64.43 -25.81 68.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.977 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.672 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 87.9 mt -65.27 -17.05 64.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.806 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.0 m -102.4 16.37 26.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.107 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.468 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 92.4 m-20 -95.29 143.88 26.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.995 0.426 . . . . 0.0 111.26 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -67.78 -16.51 64.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.903 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -85.33 160.7 19.75 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.66 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 7.3 p90 -109.17 -35.96 6.17 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.455 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.434 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 71.3 ttt180 -60.26 -32.07 70.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.824 0.345 . . . . 0.0 111.224 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 59.3 mt -82.43 -38.39 15.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.501 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.672 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 43.1 ttm180 -64.58 -46.79 81.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.423 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -59.49 -47.89 88.65 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.67 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.93 -27.96 54.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.716 0.293 . . . . 0.0 111.253 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.463 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.33 -56.42 22.36 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.038 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.402 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -65.54 -28.54 69.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.948 0.404 . . . . 0.0 110.801 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.3 m95 -55.4 -42.87 74.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.228 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.8 mt -99.08 -20.37 5.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.545 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.508 HD11 ' NH1' ' A' ' 53' ' ' ARG . 0.2 OUTLIER -56.81 -37.33 53.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.58 -179.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.01 -20.5 60.26 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.93 -0.653 . . . . 0.0 113.399 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -69.83 -21.12 63.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -82.61 -27.74 31.27 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.626 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.0 OUTLIER 57.66 27.25 13.99 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.94 0.4 . . . . 0.0 111.38 179.828 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -100.96 158.38 16.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.162 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -56.77 -36.75 70.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.477 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.523 ' HD2' ' O ' ' A' ' 53' ' ' ARG . 0.8 OUTLIER -63.73 -27.55 69.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.891 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.498 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -96.11 0.14 50.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.228 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.6 t -90.83 -41.05 13.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.392 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.555 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 19.1 tt0 -60.61 -49.18 91.02 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 50.5 Cg_exo -54.03 -17.35 10.93 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.647 2.231 . . . . 0.0 113.222 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.54 HD22 ' OG ' ' A' ' 76' ' ' SER . 12.9 mt -86.54 -31.79 21.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.844 0.354 . . . . 0.0 110.93 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.6 mm -63.33 -52.62 56.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.984 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -70.17 -44.55 68.54 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' ' 69' ' ' VAL . 2.0 tp -57.66 -35.74 70.96 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -177.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.709 HD13 HD22 ' A' ' 92' ' ' LEU . 35.2 mt -59.01 -12.08 4.22 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -113.08 -3.6 13.96 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.42 ' OD1' ' HA ' ' A' ' 61' ' ' LEU . 0.9 OUTLIER -60.98 -33.62 73.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.153 0.501 . . . . 0.0 111.117 179.945 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.532 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 17.9 t70 50.34 26.77 2.4 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.373 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.477 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.6 t -82.37 -17.34 45.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.943 0.401 . . . . 0.0 110.372 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 122.2 -114.45 2.5 Favored Glycine 0 N--CA 1.452 -0.254 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.444 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.434 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -55.06 -27.94 48.53 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.376 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.642 HG12 ' HG ' ' A' ' 61' ' ' LEU . 39.5 t -64.92 -38.94 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.621 178.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.532 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 44.1 ttp180 -74.69 -40.15 61.55 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.595 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 55.0 m -64.85 -33.74 76.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.09 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.35 -60.35 8.67 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.444 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.538 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . . . -57.12 -31.53 65.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.872 0.368 . . . . 0.0 111.048 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.97 -59.05 5.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.737 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -67.11 -37.51 84.0 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.098 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.54 ' OG ' HD22 ' A' ' 58' ' ' LEU . 60.7 p -53.29 -40.22 64.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.752 0.31 . . . . 0.0 111.237 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.421 ' HB3' HG13 ' A' ' 85' ' ' VAL . 35.2 mt -67.7 -60.17 2.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.828 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -53.18 -25.8 15.0 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.111 0.481 . . . . 0.0 110.219 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.462 HE21 ' HA ' ' A' ' 76' ' ' SER . 4.7 tt0 -68.23 -41.55 81.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.066 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.626 HG12 ' HG3' ' A' ' 50' ' ' GLN . 89.3 mt -63.13 -55.4 23.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.727 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.42 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 66.24 119.34 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.57 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.77 -179.97 27.92 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.278 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -66.38 -33.96 76.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.72 0.295 . . . . 0.0 110.922 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.512 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -62.97 -38.31 90.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.11 -179.78 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.431 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 19.8 t -64.8 -37.16 79.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.819 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 39.4 ttp180 -59.19 -27.36 65.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.513 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.29 76.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.025 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.65 88.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.929 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.54 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 14.4 mmt -66.77 -49.41 65.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.691 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -56.42 -34.98 67.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.82 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.14 -27.59 48.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.985 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.709 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -86.17 -19.79 29.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.16 0.505 . . . . 0.0 109.745 179.663 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.69 -19.95 60.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.692 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.51 -27.6 37.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.332 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 15.6 p -120.18 18.3 12.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.333 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -53.48 125.92 33.12 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.968 -1.015 . . . . 0.0 113.268 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.4 t -139.79 130.32 25.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.035 0.445 . . . . 0.0 110.845 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.23 -121.29 26.17 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.005 -0.617 . . . . 0.0 113.132 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -75.87 -36.53 59.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.66 0.267 . . . . 0.0 111.685 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.495 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.84 -39.72 59.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.871 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -66.33 -59.98 3.2 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.485 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -45.7 -32.85 2.64 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.869 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.442 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 19.9 t -58.98 -59.92 3.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.656 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.516 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.33 -56.4 22.56 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 88.6 t -59.46 -60.68 2.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -178.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -55.4 -37.42 67.58 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.54 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 43.5 t80 -62.84 -22.77 66.9 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 120.907 0.384 . . . . 0.0 110.958 -178.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.4 mt -58.39 -17.21 18.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.166 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -64.79 -24.08 67.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.662 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.1 p -102.39 -58.01 1.95 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.818 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 44.1 m80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.295 -0.86 . . . . 0.0 110.835 179.891 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.452 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.627 0.251 . . . . 0.0 111.395 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.499 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 1.5 t80 -63.34 -48.64 77.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.108 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.444 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 8.6 mt-10 -62.58 -58.1 18.76 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.949 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 11.8 Cg_endo -56.01 -15.54 14.01 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 121.859 1.706 . . . . 0.0 110.955 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.828 HD21 HG13 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -79.12 -38.81 35.24 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.593 179.293 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.502 HD11 ' HG2' ' A' ' 53' ' ' ARG . 7.4 mt -82.18 -22.17 36.14 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.383 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.13 -31.96 69.41 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.512 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.49 ' OG ' HG22 ' A' ' 38' ' ' ILE . 1.5 t -66.18 -26.52 67.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.638 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.589 ' HA ' ' HD2' ' A' ' 39' ' ' ARG . 76.4 mt -56.35 -17.74 8.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.864 -179.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.2 m -90.7 21.73 3.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.612 0.244 . . . . 0.0 111.491 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -114.27 123.37 49.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.988 0.423 . . . . 0.0 111.313 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -67.88 -5.6 17.55 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.375 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -75.89 155.85 34.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 0.0 110.947 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.3 p-90 -89.79 -35.0 15.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.068 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -69.35 -33.24 72.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.901 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.49 HG22 ' OG ' ' A' ' 30' ' ' SER . 40.5 mm -82.11 -55.01 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.876 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.589 ' HD2' ' HA ' ' A' ' 31' ' ' LEU . 8.2 tpt180 -57.25 -40.37 77.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.053 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.27 -58.62 10.04 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.931 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.97 -27.31 0.88 Allowed 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.05 -56.78 9.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.843 0.354 . . . . 0.0 111.196 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.578 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -66.41 -37.22 84.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.953 0.406 . . . . 0.0 111.008 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -55.77 -33.4 64.31 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.723 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.3 mm -98.75 -20.45 5.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.187 0.518 . . . . 0.0 110.849 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.828 HG13 HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -60.74 -41.38 88.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.754 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.529 ' HA3' HE21 ' A' ' 79' ' ' GLN . . . -59.75 -16.08 36.75 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.716 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -70.73 -43.34 69.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.474 0.178 . . . . 0.0 111.227 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -92.82 105.7 17.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.78 0.324 . . . . 0.0 110.631 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' ' 80' ' ' ILE . 23.7 mp0 -71.82 74.37 0.86 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.524 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -127.82 155.49 44.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.161 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.409 ' HA ' HG23 ' A' ' 55' ' ' VAL . 9.4 pt-20 -64.92 -29.13 70.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.424 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.502 ' HG2' HD11 ' A' ' 28' ' ' LEU . 33.4 ttm180 -69.26 -10.43 57.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.337 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.611 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -105.97 12.97 29.94 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.882 0.372 . . . . 0.0 111.009 -179.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.409 HG23 ' HA ' ' A' ' 52' ' ' GLU . 53.2 t -86.63 -50.11 14.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.009 -0.542 . . . . 0.0 112.182 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 42.1 tt0 -55.08 -48.43 96.11 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 94.5 Cg_exo -45.47 -33.77 9.8 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.426 2.084 . . . . 0.0 112.987 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.428 HD22 ' HB2' ' A' ' 76' ' ' SER . 8.7 mt -75.17 -40.77 59.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.829 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.487 HD11 ' HA ' ' A' ' 88' ' ' ALA . 41.0 mm -54.78 -52.96 37.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.16 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -70.09 -22.33 63.05 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.602 ' HG ' HG12 ' A' ' 69' ' ' VAL . 3.0 mp -89.42 -40.13 12.93 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.526 HD11 HD11 ' A' ' 77' ' ' LEU . 13.3 mt -62.2 -10.88 11.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.349 0.595 . . . . 0.0 110.346 -179.238 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -90.67 -39.86 12.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.98 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.485 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 34.5 m-20 -56.52 -179.8 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.76 -178.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -153.33 29.7 0.49 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.762 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.424 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 53.3 m -83.66 -3.41 57.72 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.285 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.49 -98.75 2.41 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.392 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -48.69 -32.72 8.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.235 0.54 . . . . 0.0 110.012 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.602 HG12 ' HG ' ' A' ' 61' ' ' LEU . 60.1 t -72.8 -56.78 8.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.104 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 7.3 tmm_? -65.2 -63.66 1.05 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.339 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 97.3 p -52.05 -22.84 4.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.293 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.16 -43.65 98.33 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.594 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.51 ' O ' HD12 ' A' ' 77' ' ' LEU . . . -75.32 -36.84 61.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.573 0.225 . . . . 0.0 111.377 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.22 -40.47 64.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.526 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.3 ptp180 -84.45 -16.58 42.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.489 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.428 ' HB2' HD22 ' A' ' 58' ' ' LEU . 54.9 m -65.91 -45.05 83.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.792 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.54 ' HA ' HG21 ' A' ' 85' ' ' VAL . 5.0 mp -55.8 -59.4 4.93 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.454 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -53.74 -29.46 39.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.804 -0.18 . . . . 0.0 111.099 179.716 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.529 HE21 ' HA3' ' A' ' 47' ' ' GLY . 21.0 mt-30 -70.6 -31.99 69.18 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 121.018 0.437 . . . . 0.0 110.346 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.529 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 95.2 mt -80.43 -60.71 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.173 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.76 113.38 0.01 OUTLIER Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.978 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.91 164.1 12.0 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.633 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -64.03 -26.37 68.53 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.805 0.336 . . . . 0.0 110.837 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.556 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -65.95 -53.49 38.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.764 179.894 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.556 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 12.3 p -70.8 -24.77 25.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.389 0.614 . . . . 0.0 110.263 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.439 ' O ' ' HG3' ' A' ' 89' ' ' MET . 17.0 ttp180 -55.88 -20.87 17.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.72 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.02 -34.07 64.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.364 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.487 ' HA ' HD11 ' A' ' 59' ' ' ILE . . . -60.0 -48.58 81.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.851 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.542 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.23 -31.75 69.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.375 179.739 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.35 -36.51 83.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.164 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 42.7 mmtm -79.94 -28.11 39.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.121 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.491 HD22 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -82.48 -24.03 34.42 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.78 -12.49 61.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.738 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -95.86 -14.87 22.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.914 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.0 p -135.12 16.99 3.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.598 0.713 . . . . 0.0 109.199 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -61.5 148.19 47.22 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 114.734 -1.121 . . . . 0.0 113.226 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.426 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 4.3 t -151.25 130.35 12.65 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.79 -0.705 . . . . 0.0 111.001 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.03 -130.11 50.53 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.976 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.449 ' O ' HG23 ' A' ' 103' ' ' VAL . 78.0 t80 -60.42 -47.54 85.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.635 0.255 . . . . 0.0 111.389 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.435 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.17 -41.5 49.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.51 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.426 ' HB2' ' N ' ' A' ' 97' ' ' THR . 9.3 tpt180 -61.52 -61.68 2.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.384 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -53.3 -27.69 24.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.119 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 99' ' ' PHE . 13.5 t -63.97 -45.79 95.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.954 -179.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -62.56 -58.95 5.74 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 106' ' ' ASN . 7.3 p -64.43 -52.84 50.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.515 ' N ' HG13 ' A' ' 105' ' ' VAL . 27.1 t-20 -55.78 -32.49 63.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.646 0.26 . . . . 0.0 111.616 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -60.32 -29.24 68.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.058 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 14.1 mt -51.44 -22.36 2.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.65 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.74 3.69 3.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.268 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 53.7 m -105.37 -60.36 1.63 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.788 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.418 ' HD2' ' HD3' ' A' ' 86' ' ' ARG . 82.9 t60 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.638 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.48 ' O ' ' HB3' ' A' ' 27' ' ' LEU . . . . . . . . 0 N--CA 1.457 -0.115 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.424 ' HA ' HD23 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -59.47 -49.42 77.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.999 0.428 . . . . 0.0 110.805 -179.81 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.418 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 10.8 mt-10 -63.42 -58.92 13.43 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.438 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.463 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 15.0 Cg_endo -56.46 -14.38 12.6 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 121.87 1.714 . . . . 0.0 111.062 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.546 HD11 HG12 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -82.9 -39.0 22.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.535 178.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.429 HD12 HD12 ' A' ' 31' ' ' LEU . 8.7 tp -85.86 -21.38 28.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.325 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -75.81 -37.56 58.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.708 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 60.9 p -65.3 -23.99 67.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.27 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.429 HD12 HD12 ' A' ' 28' ' ' LEU . 86.2 mt -59.2 -7.26 1.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.673 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.5 p -89.92 19.62 4.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.21 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.614 HD21 ' HG3' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -88.19 147.76 24.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.138 0.494 . . . . 0.0 111.432 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.84 -25.74 65.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.622 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.1 162.32 28.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.968 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -110.12 -26.05 9.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.95 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 37' ' ' ARG . 23.4 ttt180 -58.9 -48.16 82.42 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.742 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.4 mm -56.44 -49.85 75.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.339 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.614 ' HG3' HD21 ' A' ' 33' ' ' ASN . 77.8 mtt180 -52.81 -23.84 7.73 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.598 178.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -60.78 -66.59 2.6 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.484 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.3 -42.33 69.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.778 0.323 . . . . 0.0 111.224 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.447 ' HB1' HD12 ' A' ' 27' ' ' LEU . . . -58.02 -54.9 41.73 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.676 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.82 -34.72 74.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.6 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -68.7 -28.07 66.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.773 -179.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.2 mm -91.41 -21.6 6.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.927 0.394 . . . . 0.0 110.54 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.648 HG23 ' HB1' ' A' ' 54' ' ' ALA . 2.4 mm -55.78 -35.16 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.251 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.91 -28.26 63.19 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.869 -0.681 . . . . 0.0 113.022 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.704 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.6 OUTLIER -55.4 -51.44 66.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.9 0.381 . . . . 0.0 110.255 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -83.98 115.58 22.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.741 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.68 25.4 0.78 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.132 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.506 ' O ' HG23 ' A' ' 55' ' ' VAL . 6.2 m-20 -84.0 162.45 20.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.376 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.441 ' H ' ' CD ' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -61.58 -37.06 82.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.589 -179.551 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.6 ttp180 -64.45 -11.32 32.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.986 0.422 . . . . 0.0 110.367 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.648 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -106.02 -10.99 16.3 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.709 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 51' ' ' ASP . 93.6 t -79.05 -44.51 24.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.654 -179.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.563 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -57.69 -51.06 84.51 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.496 -179.564 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.563 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.0 Cg_exo -45.29 -51.67 7.52 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.296 1.997 . . . . 0.0 112.252 179.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.522 HD22 ' HA ' ' A' ' 73' ' ' ALA . 16.7 mt -60.63 -35.57 76.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.484 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 55' ' ' VAL . 42.6 mm -62.78 -59.75 3.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.703 0.287 . . . . 0.0 111.585 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.457 ' H ' ' HG3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -70.07 -4.97 23.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.693 -179.341 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.726 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -89.59 -44.44 10.08 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -179.353 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.689 HD13 HD22 ' A' ' 92' ' ' LEU . 5.1 mt -56.74 -15.81 5.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.887 0.375 . . . . 0.0 111.4 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -110.85 -9.33 14.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.501 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.402 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.7 t70 -61.06 -33.43 73.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.108 0.48 . . . . 0.0 111.212 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.583 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 16.5 t70 54.84 28.98 11.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.688 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.497 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 37.8 t -85.33 -10.94 55.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.636 0.255 . . . . 0.0 111.404 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 96.09 -84.33 0.85 Allowed Glycine 0 C--O 1.228 -0.26 0 C-N-CA 120.712 -0.756 . . . . 0.0 111.97 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.66 -41.52 98.2 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.726 HG12 ' HG ' ' A' ' 61' ' ' LEU . 5.2 t -71.97 -43.46 67.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.133 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.583 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 8.3 ttt180 -69.52 -63.36 1.09 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.703 0.287 . . . . 0.0 111.027 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.9 m -52.49 -23.06 5.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.821 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -66.9 -37.43 92.19 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.147 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.522 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -69.72 -47.47 62.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.649 0.261 . . . . 0.0 111.003 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.23 -26.2 62.58 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.214 0.531 . . . . 0.0 110.002 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.9 ttt180 -82.93 -40.45 20.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.449 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.654 ' HA ' HE21 ' A' ' 79' ' ' GLN . 69.8 m -66.94 -33.24 75.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.676 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.553 HD11 HD11 ' A' ' 62' ' ' LEU . 96.8 mt -65.36 -59.72 3.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.675 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.426 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 36.8 tt0 -51.57 -23.09 3.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.161 0.505 . . . . 0.0 110.032 178.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.654 HE21 ' HA ' ' A' ' 76' ' ' SER . 1.1 tt0 -68.02 -48.14 66.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.985 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 82.2 mt -58.21 -60.22 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.713 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 61.13 107.16 0.01 OUTLIER Glycine 0 C--N 1.332 0.356 0 C-N-CA 121.092 -0.575 . . . . 0.0 113.07 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 155.33 -175.47 33.26 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.621 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -71.34 -26.81 62.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.842 0.353 . . . . 0.0 110.737 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.598 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -68.68 -49.71 56.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 -179.746 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.598 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 11.4 p -70.83 -26.93 28.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.276 0.56 . . . . 0.0 110.798 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.431 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 54.7 ttt180 -58.78 -24.59 62.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.532 -179.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.94 -29.0 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.93 0.395 . . . . 0.0 110.701 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.73 -37.68 88.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.71 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.537 ' SD ' HD13 ' A' ' 77' ' ' LEU . 6.7 mmm -66.76 -44.38 81.55 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 12.3 mm-40 -57.42 -38.63 74.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.146 178.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -74.49 -29.49 61.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.547 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.689 HD22 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -87.25 -23.48 24.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.005 0.431 . . . . 0.0 110.296 179.48 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.84 -29.16 69.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.422 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.539 ' HG3' HG23 ' A' ' 95' ' ' THR . 11.2 pt-20 -80.17 -18.13 50.53 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.245 0.545 . . . . 0.0 109.779 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.539 HG23 ' HG3' ' A' ' 94' ' ' GLU . 72.0 p -121.93 21.91 10.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.935 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.432 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -60.64 123.12 31.9 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 114.843 -1.071 . . . . 0.0 113.687 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.3 t -147.76 130.06 15.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.809 0.337 . . . . 0.0 110.786 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.7 -132.77 20.42 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.158 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -77.86 -30.89 51.13 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.658 0.266 . . . . 0.0 111.321 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.539 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -55.27 -37.92 67.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.468 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.432 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 44.5 ttt180 -67.41 -59.02 3.73 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.667 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.2 tppt? -47.33 -21.69 0.33 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.961 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.457 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 18.7 t -75.4 -56.98 7.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.92 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.514 ' O ' ' HG ' ' A' ' 108' ' ' LEU . . . -51.31 -57.6 8.44 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 113.502 0.926 . . . . 0.0 113.502 -178.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.8 t -58.35 -63.6 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -176.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -59.03 -35.2 72.91 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.532 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 42.9 t80 -63.29 -25.76 68.46 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-O 120.829 0.347 . . . . 0.0 111.116 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 96.8 mt -56.59 -20.79 22.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.882 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -62.65 -12.35 22.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.977 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.4 p -132.05 20.01 4.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.315 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 65.6 m80 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.065 179.59 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.469 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.72 0.295 . . . . 0.0 111.611 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.548 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 2.7 t80 -63.47 -48.84 76.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.819 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.523 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.3 -50.39 74.82 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -179.207 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.523 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 87.6 Cg_exo -41.93 -24.46 0.3 Allowed 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 122.204 1.936 . . . . 0.0 111.719 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 47.1 mt -76.06 -53.02 8.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.133 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 31' ' ' LEU . 24.6 tp -66.98 -24.16 66.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.889 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -76.27 -42.71 44.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.558 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 52.3 m -66.43 -11.18 50.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.981 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 28' ' ' LEU . 38.7 mt -67.17 -10.11 46.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.102 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.7 t -100.21 14.36 31.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.511 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -68.91 150.08 48.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.83 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -63.09 -39.4 94.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.038 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -76.12 156.75 33.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.797 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 7.5 m0 -99.93 -33.03 10.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.644 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -64.94 -46.72 80.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.864 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.3 mt -60.4 -39.27 80.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.603 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.611 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 39.0 ttm180 -63.78 -20.75 66.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.335 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.08 -57.56 11.61 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.778 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.66 -36.44 4.87 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.456 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -67.21 -50.86 59.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.91 0.386 . . . . 0.0 110.69 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.406 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -64.05 -32.77 74.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.989 179.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -70.8 -33.92 71.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.49 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.0 mt -99.21 -19.36 5.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.461 HD13 ' HG2' ' A' ' 57' ' ' PRO . 5.6 tt -59.31 -38.03 72.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -178.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.438 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -76.14 -14.01 82.69 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.512 -0.851 . . . . 0.0 112.505 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.642 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER -70.69 -15.46 62.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.558 0.218 . . . . 0.0 111.148 -179.697 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -83.02 -22.77 33.5 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.322 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 59.94 24.97 14.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.216 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -93.45 163.36 13.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.152 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.493 ' O ' HG22 ' A' ' 55' ' ' VAL . 13.4 tp10 -66.08 -35.37 80.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.98 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.8 ttm180 -64.3 -10.03 21.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.317 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.548 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -101.96 18.63 20.18 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.493 HG22 ' O ' ' A' ' 52' ' ' GLU . 20.4 m -91.8 -46.35 14.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.478 ' N ' HG23 ' A' ' 55' ' ' VAL . 4.6 tp10 -59.8 -49.45 91.56 Favored Pre-proline 0 CA--C 1.531 0.216 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.0 Cg_exo -45.16 -53.08 5.7 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.993 1.795 . . . . 0.0 111.895 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.479 HD22 ' HB2' ' A' ' 76' ' ' SER . 7.8 mt -57.61 -36.81 72.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.13 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 74.9 mt -63.47 -59.53 4.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.416 ' HG3' HD13 ' A' ' 61' ' ' LEU . 13.6 pttm -66.28 -37.64 85.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.795 0.331 . . . . 0.0 111.631 -178.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.748 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -54.48 -51.82 63.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.923 -179.456 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.486 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 75.1 mt -58.35 -15.85 12.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.876 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.04 -22.94 15.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.586 179.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -61.34 -36.17 79.44 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.089 0.471 . . . . 0.0 111.302 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.539 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 20.3 t70 57.44 28.06 14.87 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.019 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.51 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 8.0 t -73.35 -11.86 60.63 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.747 0.308 . . . . 0.0 111.116 -179.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.34 -79.01 0.51 Allowed Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.08 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.96 -39.27 69.47 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.748 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.5 t -71.79 -41.49 70.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.84 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.539 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 6.2 tmm_? -67.73 -58.54 4.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.179 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.0 m -57.75 -35.13 70.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.7 -179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -55.75 -30.29 56.23 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.72 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.28 -52.02 15.47 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -45.98 -47.41 16.66 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -70.13 -30.13 67.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.604 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.651 ' HA ' HE21 ' A' ' 79' ' ' GLN . 50.3 m -65.22 -38.64 91.04 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.435 ' HG ' HG11 ' A' ' 85' ' ' VAL . 8.2 mp -55.56 -59.36 4.94 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.775 0.321 . . . . 0.0 111.026 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 41.7 mt-10 -55.46 -35.96 66.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.974 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.651 HE21 ' HA ' ' A' ' 76' ' ' SER . 22.1 mt-30 -61.99 -23.63 66.54 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.509 HG22 ' HD2' ' A' ' 84' ' ' ARG . 39.8 mt -90.22 -61.72 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.444 ' N ' ' NH1' ' A' ' 84' ' ' ARG . . . 64.33 125.62 0.01 OUTLIER Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.962 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.458 ' O ' ' NH2' ' A' ' 84' ' ' ARG . . . 141.97 -169.95 25.1 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.611 -0.804 . . . . 0.0 113.149 179.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' A' ' 86' ' ' ARG . 34.8 tt0 -72.91 -22.51 60.73 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.77 ' NE ' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.27 -65.38 0.68 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.187 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.77 ' H ' ' NE ' ' A' ' 84' ' ' ARG . 47.8 t -70.8 -20.52 22.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.08 0.467 . . . . 0.0 109.822 178.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.591 ' HA ' ' HE2' ' A' ' 89' ' ' MET . 2.2 tmm_? -46.25 -36.25 5.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.207 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -86.22 -27.86 24.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.705 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.441 ' HB3' HG13 ' A' ' 85' ' ' VAL . . . -65.19 -49.57 69.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.902 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.591 ' HE2' ' HA ' ' A' ' 86' ' ' ARG . 9.3 ptt? -58.73 -41.56 86.72 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.84 0.352 . . . . 0.0 110.294 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -63.2 -29.97 71.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.026 0.441 . . . . 0.0 109.855 178.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.451 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 10.8 tmtt? -71.06 -42.17 69.77 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.562 179.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.625 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -74.8 -24.47 58.65 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.543 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.16 -27.68 64.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.46 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -81.57 -26.58 34.85 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.619 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 74.1 p -109.67 20.91 17.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.352 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -55.41 115.59 5.96 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.027 -0.988 . . . . 0.0 113.441 -178.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.6 m -140.0 129.91 24.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.719 0.295 . . . . 0.0 110.697 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.18 -141.92 46.97 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.812 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -63.83 -25.28 68.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 111.202 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.563 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -55.63 -44.07 76.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.815 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.459 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 34.3 ttp180 -64.07 -53.77 44.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.704 0.288 . . . . 0.0 111.412 -179.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.6 tptp -50.28 -22.04 1.62 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.887 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.563 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 4.8 t -73.16 -57.58 6.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.901 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.625 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.32 -52.66 64.44 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 51.1 t -60.7 -45.87 96.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.52 ' N ' HD22 ' A' ' 106' ' ' ASN . 0.9 OUTLIER -70.75 -39.03 73.53 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.166 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.515 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 41.2 t80 -63.51 -23.92 67.59 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.163 0.506 . . . . 0.0 111.024 -178.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.493 ' HG ' ' HE3' ' A' ' 89' ' ' MET . 0.5 OUTLIER -49.98 -30.87 11.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.88 179.516 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.579 ' HG3' HG23 ' A' ' 110' ' ' THR . 12.1 pt-20 -65.12 -8.89 18.79 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.579 HG23 ' HG3' ' A' ' 109' ' ' GLU . 62.9 p -130.44 19.12 5.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.618 0.247 . . . . 0.0 111.42 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.2 m80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.994 179.866 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.914 0.388 . . . . 0.0 111.132 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.494 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -59.38 -50.62 73.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.652 -179.604 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.437 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -57.56 -57.36 25.83 Favored Pre-proline 0 C--N 1.325 -0.5 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.185 -179.935 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.527 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 1.1 Cg_endo -49.95 -26.39 14.12 Favored 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 121.944 1.763 . . . . 0.0 111.099 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.642 HD21 ' HA ' ' A' ' 46' ' ' ILE . 0.4 OUTLIER -73.75 -41.93 61.8 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.104 178.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.692 HD12 HD12 ' A' ' 31' ' ' LEU . 7.2 tp -76.84 -17.97 58.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.155 -0.93 . . . . 0.0 109.492 178.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -70.65 -32.36 69.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.619 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.431 ' OG ' HG22 ' A' ' 38' ' ' ILE . 23.3 t -65.93 -27.09 67.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.188 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.692 HD12 HD12 ' A' ' 28' ' ' LEU . 69.8 mt -66.52 -9.91 39.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.859 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 43.3 t -93.88 16.89 13.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.1 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -100.58 139.42 36.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.931 0.396 . . . . 0.0 111.144 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.69 -16.95 64.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.328 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -78.9 127.51 32.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.845 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -82.41 -27.39 32.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.132 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -62.96 -48.09 80.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.856 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.431 HG22 ' OG ' ' A' ' 30' ' ' SER . 62.0 mt -73.07 -44.36 56.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.015 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.675 ' HG3' HD23 ' A' ' 31' ' ' LEU . 42.8 ttp180 -59.51 -27.5 66.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.821 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.83 -58.43 14.63 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.499 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.52 -42.72 67.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.673 0.273 . . . . 0.0 111.519 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.428 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.97 -56.16 24.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.856 0.36 . . . . 0.0 111.059 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.424 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -61.19 -31.4 71.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.256 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -69.93 -34.93 74.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.694 -0.684 . . . . 0.0 112.736 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.555 ' HA ' HD22 ' A' ' 48' ' ' ASN . 26.1 mm -98.93 -19.47 5.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.858 0.361 . . . . 0.0 111.843 -178.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.642 ' HA ' HD21 ' A' ' 27' ' ' LEU . 5.8 tt -57.23 -36.63 52.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.932 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.584 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -76.69 -12.55 84.36 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.457 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.555 HD22 ' HA ' ' A' ' 45' ' ' ILE . 21.4 m-80 -68.77 -21.17 64.37 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -83.85 -36.22 23.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.62 0.248 . . . . 0.0 111.249 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.562 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.8 OUTLIER 68.38 55.81 0.5 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.123 179.735 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.455 ' O ' HG23 ' A' ' 55' ' ' VAL . 7.5 m-20 -127.79 -178.28 4.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.02 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.36 -38.44 91.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.954 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -65.7 -12.08 50.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.052 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.9 7.51 32.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.051 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 51' ' ' ASP . 86.1 t -91.37 -59.28 3.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.412 -178.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.44 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 22.5 tt0 -60.09 -49.4 91.17 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.44 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 83.1 Cg_exo -42.56 -52.78 4.2 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.334 2.023 . . . . 0.0 112.86 -179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.528 HD22 ' HA ' ' A' ' 73' ' ' ALA . 12.0 mt -59.81 -34.76 73.47 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.741 -179.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 55' ' ' VAL . 51.3 mm -63.44 -59.89 3.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.83 -6.37 37.44 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.698 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -89.42 -37.13 15.04 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.478 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.534 HD13 HD22 ' A' ' 92' ' ' LEU . 5.9 mt -62.97 -9.64 10.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.492 . . . . 0.0 110.651 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -112.48 -12.61 13.47 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.995 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.438 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.0 t0 -61.03 -30.05 70.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.256 0.55 . . . . 0.0 110.668 179.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.442 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 38.5 m-20 48.58 30.62 2.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.698 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.521 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 18.4 t -83.82 -5.66 59.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.717 0.294 . . . . 0.0 111.118 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.12 -80.55 1.2 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.279 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -67.52 -43.8 79.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.123 0.487 . . . . 0.0 109.824 179.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.698 HG12 ' HG ' ' A' ' 61' ' ' LEU . 42.3 t -73.45 -38.53 53.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.576 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.442 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 4.8 tmm_? -72.55 -62.62 1.38 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.09 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.2 t -51.99 -27.76 14.55 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.865 0.364 . . . . 0.0 110.813 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.49 -45.76 95.02 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.097 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.528 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -59.89 -45.26 93.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.945 0.402 . . . . 0.0 110.49 179.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.567 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.84 -24.68 67.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.571 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 ttt85 -83.64 -39.01 20.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.333 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.584 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 51.5 m -66.66 -35.82 81.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.01 -179.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.52 HD22 HG13 ' A' ' 85' ' ' VAL . 77.7 mt -55.5 -60.12 3.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.737 0.303 . . . . 0.0 111.226 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -53.98 -29.38 42.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.952 0.406 . . . . 0.0 110.289 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.44 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 48.1 mt-30 -70.41 -38.76 74.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.292 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.562 HG12 ' HG3' ' A' ' 50' ' ' GLN . 67.8 mt -75.89 -61.08 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.149 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.522 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 57.99 110.64 0.01 OUTLIER Glycine 0 C--N 1.332 0.312 0 C-N-CA 121.154 -0.546 . . . . 0.0 113.207 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.95 -171.36 37.0 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.769 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -62.56 -40.35 96.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.844 0.354 . . . . 0.0 110.632 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.404 ' H ' ' CD ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -58.48 -43.81 89.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.448 179.81 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.522 HG21 ' N ' ' A' ' 81' ' ' GLY . 2.2 t -70.94 -27.58 30.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.589 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HA ' ' SD ' ' A' ' 89' ' ' MET . 0.0 OUTLIER -55.9 -31.44 62.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.804 -179.697 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.52 -19.62 30.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.818 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.87 -50.94 53.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.572 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.405 ' SD ' ' HA ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -72.17 -28.64 63.35 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.815 0.341 . . . . 0.0 110.883 -179.566 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -69.59 -33.03 72.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.801 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -80.66 -25.4 38.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.088 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.708 HD21 ' O ' ' A' ' 100' ' ' ALA . 3.9 tp -86.71 -31.27 21.1 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.93 -26.48 62.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.713 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -79.97 -29.1 39.52 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 36.3 p -110.59 25.88 11.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.982 178.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.516 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -47.14 108.64 0.31 Allowed Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.62 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.5 p -142.7 130.51 21.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.924 0.393 . . . . 0.0 111.241 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.58 -141.37 47.72 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.084 -0.579 . . . . 0.0 113.349 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.459 ' O ' HG23 ' A' ' 103' ' ' VAL . 28.0 t80 -68.35 -27.26 66.1 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 122.465 0.306 . . . . 0.0 111.68 -179.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.708 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -54.52 -47.71 72.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.878 0.37 . . . . 0.0 111.738 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.516 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 45.9 ttp180 -56.41 -59.97 4.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.802 -179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -45.57 -25.76 0.5 Allowed 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.953 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.585 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 52.6 t -74.68 -56.51 8.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.608 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.534 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -53.84 -47.25 71.14 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.556 ' HA ' HD12 ' A' ' 108' ' ' LEU . 48.8 t -65.48 -55.52 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -62.72 -43.74 98.03 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.416 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 31.0 t80 -60.51 -27.56 67.7 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 120.889 0.376 . . . . 0.0 111.527 -178.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.556 HD12 ' HA ' ' A' ' 105' ' ' VAL . 9.9 mt -56.58 -21.51 27.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.537 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -77.06 4.43 10.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.582 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 5.2 m -111.38 -75.76 0.61 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.749 0.309 . . . . 0.0 111.051 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.819 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.501 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.579 0.228 . . . . 0.0 111.39 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.565 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.2 t80 -63.34 -46.91 84.43 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.841 0.353 . . . . 0.0 110.316 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' A' ' 27' ' ' LEU . 37.1 mt-10 -43.34 -54.24 10.04 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.501 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 53.7 Cg_exo -35.99 -31.05 0.08 OUTLIER 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.515 2.143 . . . . 0.0 112.011 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.495 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 75.2 mt -71.71 -57.55 4.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.132 178.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.561 HD22 HD12 ' A' ' 31' ' ' LEU . 3.4 tm? -55.5 -39.66 70.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.726 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -62.75 -29.37 70.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.336 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 29.1 t -64.53 -20.42 66.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.428 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.617 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 59.5 mt -69.63 -11.74 61.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.805 0.336 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.2 m -101.99 14.61 31.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.004 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -94.05 139.51 30.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.883 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 34' ' ' GLU . 2.9 mp0 -63.22 -17.9 62.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.8 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -77.2 155.68 32.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.139 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -110.83 -39.31 4.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.667 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -60.03 -34.24 73.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.976 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.1 mt -82.61 -42.98 18.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.265 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.617 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 40.6 ttm180 -58.66 -47.54 84.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.395 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.03 -56.23 26.3 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.687 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.36 -33.76 21.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.772 0.32 . . . . 0.0 111.224 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.81 -47.48 84.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.599 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -76.6 -23.69 53.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.156 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.2 m95 -61.13 -38.39 86.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.011 0.434 . . . . 0.0 110.588 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.0 mm -99.86 -18.71 6.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.267 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.599 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -50.09 -44.61 22.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.17 -178.882 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.419 ' N ' ' CG2' ' A' ' 46' ' ' ILE . . . -72.53 -14.68 77.48 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.617 -0.801 . . . . 0.0 113.04 -179.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -70.69 -10.6 59.78 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.552 0.205 . . . . 0.0 111.552 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -92.75 -26.05 17.92 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.636 ' HG3' HG12 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 62.51 51.03 3.38 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.942 0.401 . . . . 0.0 111.123 -179.849 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -127.17 171.28 11.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.99 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.75 -36.56 83.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.794 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -66.61 -9.61 37.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.771 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.565 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -100.99 3.86 41.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.648 -179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 47.6 t -92.06 -53.23 9.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.246 -179.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.558 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 12.7 tt0 -60.15 -51.21 81.98 Favored Pre-proline 0 CA--C 1.533 0.289 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -178.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 82.8 Cg_exo -46.58 -37.31 20.08 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.332 2.021 . . . . 0.0 112.649 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.466 ' HB3' HD11 ' A' ' 77' ' ' LEU . 48.9 mt -65.77 -40.55 92.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.065 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.459 HD11 ' HA ' ' A' ' 88' ' ' ALA . 46.7 mm -52.77 -54.38 16.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.294 -0.412 . . . . 0.0 112.08 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.82 74.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.042 -178.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.786 HD23 ' H ' ' A' ' 73' ' ' ALA . 0.3 OUTLIER -64.52 -37.54 87.91 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.284 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.507 ' HB3' HD22 ' A' ' 92' ' ' LEU . 34.9 mt -59.72 -13.73 11.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.306 0.574 . . . . 0.0 110.104 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -112.51 -13.43 13.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.241 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.477 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.6 OUTLIER -61.25 93.99 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.759 179.639 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -75.04 33.95 0.1 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.083 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.474 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 10.8 t -79.36 -27.11 41.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.972 0.415 . . . . 0.0 110.404 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.74 -110.12 1.13 Allowed Glycine 0 N--CA 1.453 -0.186 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.097 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -54.68 -25.46 27.31 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.596 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.3 t -64.72 -47.28 89.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.047 178.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.408 ' NH1' ' HB3' ' A' ' 99' ' ' PHE . 1.6 ttm180 -54.58 -54.44 41.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.948 0.404 . . . . 0.0 110.423 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 80.7 p -67.24 -16.59 64.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.071 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.565 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -52.53 -67.55 2.02 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.519 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.786 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -59.24 -36.51 75.6 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.538 0.209 . . . . 0.0 111.173 179.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -45.35 -56.38 5.01 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.574 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 72' ' ' GLY . 0.0 OUTLIER -70.2 -26.73 64.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.144 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.629 ' HA ' HE21 ' A' ' 79' ' ' GLN . 51.8 m -64.77 -39.27 93.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.74 0.305 . . . . 0.0 111.032 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.466 HD11 ' HB3' ' A' ' 58' ' ' LEU . 4.8 mp -61.08 -60.45 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.873 0.368 . . . . 0.0 110.55 179.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -57.21 -19.93 23.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.636 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.629 HE21 ' HA ' ' A' ' 76' ' ' SER . 3.3 tt0 -68.08 -56.99 6.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.432 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.656 ' HB ' HG21 ' A' ' 85' ' ' VAL . 82.7 mt -64.99 -60.59 2.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.143 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.12 102.37 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.451 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 174.83 -174.6 46.76 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.673 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -68.5 -37.03 79.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.872 0.368 . . . . 0.0 110.88 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.49 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.91 -46.19 90.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.528 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.656 HG21 ' HB ' ' A' ' 80' ' ' ILE . 21.3 t -70.88 -25.14 25.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.147 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -58.42 -35.01 71.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.55 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.33 -21.85 48.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.386 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.459 ' HA ' HD11 ' A' ' 59' ' ' ILE . . . -71.4 -41.86 69.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.287 179.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.672 ' HE1' HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -72.26 -35.0 68.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.136 179.6 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -60.43 -44.88 95.33 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.513 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 3.8 tmtp? -62.34 -32.53 73.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.838 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.698 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.6 OUTLIER -83.06 -25.48 32.04 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.73 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.01 -18.92 64.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.332 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -80.3 -31.04 38.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.873 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.4 p -115.83 22.13 13.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.56 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.431 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.27 119.09 11.78 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.255 -0.884 . . . . 0.0 113.339 -178.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 26.0 m -143.83 129.11 18.83 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.744 0.306 . . . . 0.0 110.804 178.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.24 -136.34 51.05 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.861 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.495 ' O ' HG23 ' A' ' 103' ' ' VAL . 64.3 t80 -60.86 -38.01 84.1 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.797 0.332 . . . . 0.0 110.711 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.553 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.71 -41.59 56.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.879 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.431 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 38.6 ttt180 -68.91 -59.54 2.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.793 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -46.29 -23.97 0.42 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.917 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 99' ' ' PHE . 24.9 t -66.16 -60.31 2.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.276 179.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.698 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.48 -52.0 67.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.968 0.413 . . . . 0.0 111.774 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 61.7 t -57.69 -61.72 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.496 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -58.62 -30.06 66.98 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -59.71 -27.05 66.12 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.017 0.437 . . . . 0.0 110.49 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.672 HD11 ' HE1' ' A' ' 89' ' ' MET . 18.2 mt -59.99 -29.3 68.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.448 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -52.45 -25.75 10.91 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.152 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.8 p -101.91 -50.67 3.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.037 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.896 -179.817 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.508 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 121.089 0.471 . . . . 0.0 110.164 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.524 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 3.0 t80 -63.35 -46.45 86.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.925 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.436 ' O ' ' N ' ' A' ' 27' ' ' LEU . 6.4 mm-40 -63.4 -51.95 64.1 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.675 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.508 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 95.8 Cg_exo -42.93 -19.12 0.12 Allowed 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 122.427 2.085 . . . . 0.0 111.926 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.521 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.2 mt -85.66 -52.39 5.83 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.159 178.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.598 HD12 HD12 ' A' ' 31' ' ' LEU . 52.5 tp -59.29 -33.65 71.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.728 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 26' ' ' PRO . 8.6 pt-20 -61.99 -28.42 69.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.843 0.354 . . . . 0.0 110.745 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.402 ' HB3' ' HB2' ' A' ' 42' ' ' ALA . 32.8 t -63.69 -21.39 66.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.516 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.643 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 42.0 mt -67.5 -6.74 21.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.696 0.284 . . . . 0.0 111.047 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 91.5 p -113.94 20.45 15.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.318 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.04 150.42 21.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.87 0.367 . . . . 0.0 111.184 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.95 -29.18 69.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.048 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -78.29 160.69 27.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.926 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.9 p90 -111.15 -39.6 4.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.177 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -59.68 -34.65 73.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.933 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.7 mt -76.86 -42.52 33.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.683 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.643 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 27.5 ttm180 -54.16 -32.18 54.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.71 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.4 -47.07 65.19 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.232 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.3 -24.81 12.63 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.759 0.314 . . . . 0.0 111.138 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.414 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -68.58 -57.42 5.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.388 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.82 -17.5 62.15 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.24 0.543 . . . . 0.0 110.582 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -46.79 87.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.183 -179.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.456 ' HA ' HD22 ' A' ' 48' ' ' ASN . 12.6 mt -98.53 -24.32 4.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.414 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 5.1 tt -56.44 -24.59 19.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.685 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 76' ' ' SER . . . -74.44 -27.43 65.63 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.905 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.456 HD22 ' HA ' ' A' ' 45' ' ' ILE . 43.5 m-80 -59.84 -22.31 62.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.646 0.26 . . . . 0.0 111.471 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -105.07 107.73 18.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.425 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.754 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.4 mp0 -65.91 78.87 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.139 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -127.61 153.86 45.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.514 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.613 ' O ' HG22 ' A' ' 55' ' ' VAL . 13.5 pt-20 -64.91 -28.44 69.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.443 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -69.33 -12.12 61.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.363 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.524 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -104.37 21.94 15.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 52' ' ' GLU . 32.7 m -91.75 -57.88 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.717 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.581 ' N ' HG23 ' A' ' 55' ' ' VAL . 28.7 tt0 -60.31 -50.52 85.47 Favored Pre-proline 0 CA--C 1.533 0.319 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.5 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 95.1 Cg_exo -40.37 -52.03 3.15 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.495 2.13 . . . . 0.0 112.99 -179.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.451 HD22 ' OG ' ' A' ' 76' ' ' SER . 4.1 mt -62.97 -46.67 86.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.717 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 55' ' ' VAL . 47.6 mm -56.82 -56.24 15.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -70.09 -16.99 63.2 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.734 ' HG ' HG13 ' A' ' 69' ' ' VAL . 11.4 tp -90.47 -40.7 11.86 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -177.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.498 ' HA ' ' HA ' ' A' ' 70' ' ' ARG . 2.9 pp -64.6 -9.76 21.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.76 0.314 . . . . 0.0 111.657 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.479 ' HG3' HD12 ' A' ' 62' ' ' LEU . 24.0 mt-10 -98.81 -11.87 21.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.553 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.421 ' HB3' ' CG1' ' A' ' 69' ' ' VAL . 7.0 t70 -62.58 -30.64 71.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.175 0.512 . . . . 0.0 111.339 -179.077 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.683 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 12.3 m-20 63.6 23.94 13.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.935 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.418 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 25.8 t -83.68 1.37 42.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.603 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.625 ' H ' ' HG2' ' A' ' 70' ' ' ARG . . . 84.8 -94.17 1.86 Allowed Glycine 0 C--O 1.227 -0.311 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.671 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -49.33 -44.88 44.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.41 0.624 . . . . 0.0 110.066 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.734 HG13 ' HG ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -63.4 -44.76 99.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.076 -0.966 . . . . 0.0 112.271 -178.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.683 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 13.6 ptt180 -78.44 -22.48 47.56 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 67.6 m -66.85 -52.11 47.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.588 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -52.73 -47.73 57.9 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.013 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.43 ' HB1' ' O ' ' A' ' 58' ' ' LEU . . . -56.56 -39.27 73.17 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.019 0.438 . . . . 0.0 110.882 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.87 -54.2 45.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.782 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 71' ' ' SER . 6.6 ptp180 -70.99 -27.26 63.57 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.451 ' OG ' HD22 ' A' ' 58' ' ' LEU . 32.0 p -63.33 -40.04 96.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.454 0.169 . . . . 0.0 111.449 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 93.1 mt -61.43 -59.83 4.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.719 0.295 . . . . 0.0 110.572 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.402 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 38.4 tt0 -55.16 -25.73 34.1 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.095 0.474 . . . . 0.0 110.052 178.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.415 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 4.3 mt-30 -69.46 -45.0 70.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.223 179.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.754 HG23 ' HG3' ' A' ' 50' ' ' GLN . 90.4 mt -64.16 -61.13 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.712 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.46 124.53 0.01 OUTLIER Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.008 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 150.65 165.17 12.48 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.914 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -58.13 -22.27 50.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.863 0.363 . . . . 0.0 110.76 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.692 ' HD3' HG23 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -74.06 -36.67 64.37 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.895 -179.693 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.692 HG23 ' HD3' ' A' ' 84' ' ' ARG . 13.7 t -70.77 -28.59 34.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.013 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 86' ' ' ARG . 18.1 tpt85 -51.39 -29.52 15.96 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.215 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.12 -31.21 23.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.098 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.47 -56.66 12.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.592 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.515 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 3.2 ppp? -64.21 -24.87 67.83 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.563 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.433 ' N ' ' SD ' ' A' ' 89' ' ' MET . 6.0 mm-40 -68.8 -31.22 70.07 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 1.8 tmtp? -71.53 -37.24 71.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.358 179.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.589 HD21 ' O ' ' A' ' 100' ' ' ALA . 0.1 OUTLIER -82.2 -26.87 32.97 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.63 -26.32 66.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.192 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -80.17 -26.81 39.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.719 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.8 p -109.96 19.24 19.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.576 178.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.521 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -52.93 111.71 1.82 Allowed Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.276 -0.874 . . . . 0.0 113.101 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.2 t -142.85 130.85 21.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.838 0.352 . . . . 0.0 110.873 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.44 -126.6 35.89 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.729 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -80.58 -29.84 36.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.882 0.372 . . . . 0.0 110.855 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.589 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.57 -34.7 38.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.677 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.521 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 42.4 ttt180 -72.04 -56.68 5.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.738 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -45.95 -23.15 0.26 Allowed 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.769 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 53.9 t -69.92 -57.66 7.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.593 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.515 ' HB1' ' HB2' ' A' ' 89' ' ' MET . . . -59.47 -55.27 36.75 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.519 HG13 ' N ' ' A' ' 106' ' ' ASN . 7.0 p -62.64 -55.72 22.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.519 ' N ' HG13 ' A' ' 105' ' ' VAL . 27.1 t-20 -56.95 -31.23 64.77 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -178.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.416 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 7.0 t80 -60.4 -33.4 72.43 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.103 0.478 . . . . 0.0 110.635 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -54.38 -13.3 0.87 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.788 -179.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -54.2 -20.68 7.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.202 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.6 p -110.82 -69.64 0.86 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.351 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 60.9 m80 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.92 -179.929 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.469 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 120.832 0.349 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.427 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 3.8 t80 -61.62 -42.15 98.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.016 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -59.4 -54.55 54.94 Favored Pre-proline 0 C--N 1.33 -0.279 0 C-N-CA 120.629 -0.429 . . . . 0.0 111.384 -179.585 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 52.2 Cg_exo -48.28 -26.39 8.28 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.886 1.724 . . . . 0.0 110.86 178.714 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.538 HD21 HG13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -80.14 -36.41 35.26 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.618 179.472 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.717 HD12 HD12 ' A' ' 31' ' ' LEU . 9.4 tp -76.99 -24.61 52.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.446 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -68.94 -42.66 76.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.897 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.6 m -66.56 -12.87 59.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.569 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.717 HD12 HD12 ' A' ' 28' ' ' LEU . 81.1 mt -68.9 -7.16 32.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.687 0.28 . . . . 0.0 111.252 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.2 p -110.16 8.04 23.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.035 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.52 HD21 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -67.58 150.32 48.95 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.923 -179.839 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -64.12 -31.16 72.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.325 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.27 152.27 36.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.075 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 13.4 p90 -100.61 -33.33 10.35 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.161 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -58.79 -50.91 72.18 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.428 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.456 ' HB ' ' OD1' ' A' ' 33' ' ' ASN . 77.8 mt -63.22 -39.76 86.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.368 179.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.535 ' CZ ' HG11 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -62.3 -23.47 66.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.158 179.504 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.09 -59.61 4.57 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.032 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.6 -36.17 4.54 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.829 0.347 . . . . 0.0 110.78 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.409 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.53 -48.97 79.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.261 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.428 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -66.19 -30.64 71.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.042 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.0 m95 -68.31 -32.44 72.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.506 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.5 mt -98.93 -19.88 5.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.784 0.326 . . . . 0.0 111.528 -179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.538 HG13 HD21 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -60.35 -40.25 83.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.866 -178.908 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.07 -23.35 78.11 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.639 -0.791 . . . . 0.0 113.078 -179.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -70.75 2.08 4.62 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -101.22 -28.15 12.82 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.539 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.458 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.3 OUTLIER 57.26 31.48 20.17 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.117 0.484 . . . . 0.0 110.897 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -102.55 162.69 12.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.137 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -61.76 -33.49 74.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 110.574 179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.502 ' NE ' HD22 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -68.24 -16.68 64.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.354 179.721 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -96.75 -5.83 37.66 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.664 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.15 -46.29 34.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.535 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.531 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 34.6 tt0 -60.37 -50.4 85.97 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 95.0 Cg_exo -44.15 -53.85 4.38 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.549 2.166 . . . . 0.0 113.016 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.656 HD13 HD22 ' A' ' 77' ' ' LEU . 9.6 mt -54.5 -37.64 65.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.442 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.1 mm -59.67 -61.04 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -70.62 -12.21 61.42 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.782 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -89.39 -41.53 12.06 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -177.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.79 HD13 HD22 ' A' ' 92' ' ' LEU . 12.3 mt -64.49 -9.89 21.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.115 0.483 . . . . 0.0 110.997 -178.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -116.18 -12.11 11.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.703 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.471 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -61.27 -32.91 72.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.346 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.563 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 17.8 m-20 59.13 29.35 18.89 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.301 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.484 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 11.8 m -79.81 10.09 4.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.728 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 67.84 -82.29 0.17 Allowed Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.427 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -48.79 78.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.021 0.438 . . . . 0.0 110.156 179.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.782 HG12 ' HG ' ' A' ' 61' ' ' LEU . 2.1 t -72.67 -44.26 60.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.675 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.563 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 3.7 tmm_? -59.03 -48.34 81.96 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.849 0.357 . . . . 0.0 110.444 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.415 ' HB3' HH12 ' A' ' 75' ' ' ARG . 72.7 m -67.1 -36.77 82.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.787 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.05 -30.0 60.07 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.676 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.423 ' O ' HD23 ' A' ' 77' ' ' LEU . . . -80.73 -40.23 25.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.646 0.26 . . . . 0.0 110.846 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.514 ' HA ' HG11 ' A' ' 103' ' ' VAL . . . -49.83 -45.36 50.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.732 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.415 HH12 ' HB3' ' A' ' 71' ' ' SER . 3.7 ptp85 -72.24 -25.61 61.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.579 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.421 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 41.9 m -67.19 -35.54 79.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.763 -179.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.77 HD21 HD11 ' A' ' 62' ' ' LEU . 4.0 mm? -55.55 -59.95 4.11 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.837 0.351 . . . . 0.0 110.724 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -64.18 -25.76 68.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.968 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.421 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 11.8 mt-30 -61.54 -43.98 97.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.212 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.458 HG12 ' HG3' ' A' ' 50' ' ' GLN . 64.8 mt -70.22 -60.86 2.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.271 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.417 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 66.59 108.37 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.788 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.504 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 152.29 -176.26 30.62 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.653 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -71.55 -31.85 67.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.339 . . . . 0.0 110.971 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.567 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.09 -54.03 49.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.567 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 9.3 p -70.65 -24.42 25.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.135 0.493 . . . . 0.0 110.816 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -57.31 -26.82 61.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.118 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.27 -26.93 47.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.987 0.422 . . . . 0.0 110.674 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.25 -46.56 60.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.305 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.495 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.92 -33.66 70.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.867 0.365 . . . . 0.0 110.566 179.837 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.4 -41.34 98.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.428 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -70.72 -24.49 62.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.025 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.79 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -84.86 -30.08 24.76 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.08 67.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.619 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.33 -25.78 39.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.343 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.3 p -117.1 21.39 13.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.33 179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -55.52 119.77 15.31 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 114.946 -1.024 . . . . 0.0 113.46 -178.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 29.8 m -139.76 129.87 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.556 -0.322 . . . . 0.0 110.361 179.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.73 -143.47 48.65 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.757 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -63.9 -30.34 71.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.756 0.312 . . . . 0.0 111.527 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.599 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -54.15 -34.38 60.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.117 -179.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.411 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 60.3 ttt180 -70.86 -58.95 3.09 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.59 ' HG3' ' ND2' ' A' ' 106' ' ' ASN . 20.9 ttmm -45.84 -25.45 0.52 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.171 0.51 . . . . 0.0 111.082 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.514 HG11 ' HA ' ' A' ' 74' ' ' ALA . 37.7 t -67.41 -48.29 77.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.375 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.619 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -64.85 -59.31 4.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.567 0.699 . . . . 0.0 112.251 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.463 ' H ' HG22 ' A' ' 105' ' ' VAL . 0.0 OUTLIER -59.39 -63.01 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 114.731 -1.122 . . . . 0.0 113.973 -177.955 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.59 ' ND2' ' HG3' ' A' ' 102' ' ' LYS . 16.0 m-80 -55.53 -25.59 38.37 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.417 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 2.1 t80 -59.0 -35.85 73.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.039 0.447 . . . . 0.0 109.927 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 46.3 mt -52.57 -22.53 5.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.717 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -64.25 -6.29 6.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.541 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.2 m -117.12 -47.6 2.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.742 0.306 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 85.8 m-70 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.93 179.701 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.457 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.175 0 CA-C-O 120.693 0.283 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.415 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.7 t80 -61.87 -48.76 79.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.595 179.582 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.4 -55.29 36.76 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.735 179.644 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 40.4 Cg_exo -50.56 -21.33 7.54 Favored 'Trans proline' 0 C--N 1.359 1.106 0 C-N-CA 121.838 1.692 . . . . 0.0 110.432 179.058 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.63 HD21 HG13 ' A' ' 46' ' ' ILE . 1.3 tp -86.32 -38.11 17.82 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.138 -1.392 . . . . 0.0 109.966 179.768 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.696 HD12 HD12 ' A' ' 31' ' ' LEU . 15.1 tp -74.58 -21.89 59.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.41 179.208 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.53 -35.23 75.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.878 -179.717 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.0 m -63.71 -24.48 67.79 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.514 -179.665 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.696 HD12 HD12 ' A' ' 28' ' ' LEU . 90.1 mt -67.46 -16.59 64.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.12 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.4 m -100.27 12.16 37.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.793 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -85.36 144.19 28.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.057 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -67.53 -29.42 68.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.035 -179.921 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -75.93 144.92 40.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.055 -179.831 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.516 ' HB2' HG21 ' A' ' 69' ' ' VAL . 58.1 p-90 -89.39 -31.93 17.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.748 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.413 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 4.9 tmt_? -58.96 -35.43 73.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.654 179.616 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 mm -82.74 -47.02 18.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.542 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.514 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 51.3 ttp180 -57.43 -42.07 81.67 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.772 -179.273 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -55.95 -63.08 5.62 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.739 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.7 -25.98 0.84 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.65 0.262 . . . . 0.0 111.596 -179.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 39' ' ' ARG . . . -64.11 -57.0 10.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.794 0.33 . . . . 0.0 110.397 179.529 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.95 -24.95 68.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.499 179.475 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.422 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 8.1 m95 -61.2 -44.91 96.54 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.154 -179.489 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.483 ' HA ' HD22 ' A' ' 48' ' ' ASN . 27.8 mm -98.78 -19.05 6.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -178.886 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.63 HG13 HD21 ' A' ' 27' ' ' LEU . 5.8 tt -56.43 -34.25 40.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -178.499 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.42 -19.02 79.73 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.567 -0.825 . . . . 0.0 113.184 -179.277 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.483 HD22 ' HA ' ' A' ' 45' ' ' ILE . 28.9 m-80 -70.87 2.39 4.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.376 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -107.06 -18.43 13.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -179.545 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.677 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 55.97 56.54 5.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.807 0.336 . . . . 0.0 111.249 -179.679 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -127.61 161.16 29.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.023 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.433 ' HA ' HG23 ' A' ' 55' ' ' VAL . 13.1 pt-20 -65.86 -30.6 71.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.692 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.54 ' HD3' HD22 ' A' ' 28' ' ' LEU . 17.2 ttm180 -69.17 -10.89 59.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.69 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.415 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -106.3 3.17 27.34 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.066 -179.557 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.569 HG22 HH12 ' A' ' 84' ' ' ARG . 64.5 t -83.2 -55.09 7.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.173 -178.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.487 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 18.9 tt0 -59.17 -49.01 95.26 Favored Pre-proline 0 CA--C 1.532 0.271 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.69 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.487 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 90.4 Cg_exo -42.94 -32.33 2.63 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.484 2.123 . . . . 0.0 112.732 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.685 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 4.8 mt -73.35 -52.71 12.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.736 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 38.5 mm -49.25 -50.75 15.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.968 -179.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.99 -32.85 71.26 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -178.629 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.535 ' HG ' HG12 ' A' ' 69' ' ' VAL . 5.2 tp -89.82 -12.41 39.21 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.895 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.594 HD13 HD22 ' A' ' 92' ' ' LEU . 17.0 mt -72.97 -13.84 61.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.881 0.372 . . . . 0.0 111.1 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -116.03 9.78 14.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.101 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.07 -31.75 71.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.265 0.555 . . . . 0.0 110.931 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 23.3 m-20 51.9 25.14 2.88 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.237 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.9 t -86.22 -17.15 35.54 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.758 0.314 . . . . 0.0 110.825 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.76 -110.22 1.6 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.311 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.422 ' HD1' ' NE1' ' A' ' 44' ' ' TRP . 0.1 OUTLIER -60.33 -26.58 66.68 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.469 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.535 HG12 ' HG ' ' A' ' 61' ' ' LEU . 24.3 t -69.46 -30.04 44.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.628 178.685 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.463 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 57.5 ttp180 -78.38 -55.74 5.0 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.464 179.391 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.469 ' O ' ' HG3' ' A' ' 75' ' ' ARG . 46.2 m -62.37 -28.0 69.47 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.967 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.5 -59.98 9.79 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.583 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.685 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -60.68 -27.94 68.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.786 0.327 . . . . 0.0 110.911 179.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.549 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.9 -45.15 95.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.573 -179.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.519 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 28.5 mtp85 -62.2 -33.47 74.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.412 -179.578 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.8 m -50.74 -46.48 59.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.846 -178.358 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.612 ' H ' HD12 ' A' ' 77' ' ' LEU . 5.7 mp -56.96 -55.76 30.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.844 0.354 . . . . 0.0 110.133 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -59.1 -32.76 70.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.281 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 29.6 mt-30 -65.32 -30.74 71.62 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.803 0.335 . . . . 0.0 110.776 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.677 HG23 ' HG3' ' A' ' 50' ' ' GLN . 90.1 mt -90.06 -60.88 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.3 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.51 113.66 0.01 OUTLIER Glycine 0 C--N 1.331 0.27 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.016 179.754 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.03 174.89 30.39 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.629 179.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.3 -32.77 74.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.809 0.338 . . . . 0.0 111.004 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.698 HH11 HG13 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -61.48 -54.85 37.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.469 179.948 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.698 HG13 HH11 ' A' ' 84' ' ' ARG . 0.0 OUTLIER -70.72 -21.62 22.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.834 179.213 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -56.44 -27.79 57.68 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.712 179.921 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.62 -27.55 45.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.241 179.69 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.69 -47.08 79.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.666 179.497 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.499 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 3.0 ppp? -67.57 -25.91 66.02 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.76 0.314 . . . . 0.0 110.215 179.735 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.442 ' N ' ' SD ' ' A' ' 89' ' ' MET . 37.0 mt-10 -69.03 -39.27 79.32 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.707 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -69.46 -31.2 69.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.908 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.594 HD22 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -85.73 -24.29 26.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.096 -179.945 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.99 -28.76 70.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.68 179.391 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -80.34 -25.01 39.46 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.048 0.451 . . . . 0.0 110.011 179.627 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.0 p -111.99 17.48 19.63 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.393 179.215 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.436 ' HA3' ' CD ' ' A' ' 101' ' ' ARG . . . -55.76 121.5 23.4 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.887 -179.346 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.6 t -139.81 130.11 25.32 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.432 -0.384 . . . . 0.0 111.267 179.455 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 51.58 -113.23 2.24 Favored Glycine 0 C--N 1.33 0.215 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.743 179.893 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.473 ' O ' HG23 ' A' ' 103' ' ' VAL . 70.7 t80 -78.71 -33.32 46.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.756 0.312 . . . . 0.0 110.91 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.482 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.57 -39.46 64.83 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.61 -179.929 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.436 ' CD ' ' HA3' ' A' ' 96' ' ' GLY . 8.5 tpt180 -66.66 -61.28 2.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.677 0.275 . . . . 0.0 111.341 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -48.26 -26.78 2.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.884 -179.664 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.482 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 8.5 t -61.13 -52.7 58.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.022 179.53 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.499 ' HB1' ' HB2' ' A' ' 89' ' ' MET . . . -64.84 -59.81 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.124 -179.475 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 52.1 t -52.58 -63.03 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.934 -178.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -56.03 -33.94 65.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -178.844 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -61.08 -25.57 67.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.028 0.442 . . . . 0.0 111.067 -179.398 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.448 HD11 ' HE1' ' A' ' 89' ' ' MET . 81.1 mt -57.89 -21.53 43.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.735 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -96.29 7.04 47.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.77 -179.16 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 66.8 p -119.97 -16.46 8.63 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -179.125 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.427 ' HD2' ' HA ' ' A' ' 108' ' ' LEU . 7.9 p80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.066 -0.969 . . . . 0.0 110.81 -179.746 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.407 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.622 0.248 . . . . 0.0 111.582 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.589 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.2 t80 -63.26 -44.64 94.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.038 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.35 -56.17 29.49 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.407 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 89.5 Cg_exo -45.15 -26.85 2.5 Favored 'Trans proline' 0 C--N 1.358 1.052 0 C-N-CA 122.022 1.815 . . . . 0.0 111.269 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.3 mt -71.21 -55.92 7.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.142 -0.936 . . . . 0.0 109.51 178.3 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.569 HD12 HD12 ' A' ' 31' ' ' LEU . 14.8 tp -63.64 -18.49 64.0 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.95 178.814 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -82.91 -30.17 28.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.66 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.474 ' OG ' HG22 ' A' ' 38' ' ' ILE . 44.2 t -65.09 -17.16 64.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.995 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.657 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 89.1 mt -66.28 -20.88 66.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.941 179.978 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.2 m -89.78 19.17 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.605 179.502 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -101.48 131.6 47.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.053 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -66.87 -11.32 55.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.469 -179.658 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -86.38 133.42 33.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.903 0.383 . . . . 0.0 111.329 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 53.8 p-90 -79.03 -32.1 44.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.366 179.423 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -64.97 -50.43 66.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.14 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.474 HG22 ' OG ' ' A' ' 30' ' ' SER . 71.5 mt -66.94 -51.7 51.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.228 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.657 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 32.1 ttm180 -58.59 -24.62 61.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.815 0.341 . . . . 0.0 110.707 -179.944 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.27 -57.55 7.43 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.48 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.17 -37.86 36.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.658 0.266 . . . . 0.0 111.415 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.63 -52.69 64.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.911 0.386 . . . . 0.0 110.758 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.446 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -66.07 -33.55 76.05 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.12 179.588 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -66.3 -28.92 69.06 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.432 -178.827 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 53.5 mt -100.09 -27.14 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.849 0.357 . . . . 0.0 111.567 -179.026 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.445 HD12 ' HB3' ' A' ' 27' ' ' LEU . 1.1 tt -58.39 -30.95 41.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.023 -178.943 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -68.38 -21.24 74.12 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.513 -179.299 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -70.57 -25.21 62.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.888 0.344 . . . . 0.0 111.9 -179.318 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -69.68 -35.22 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -179.45 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.62 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 41.3 mt-30 64.99 17.62 11.16 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.058 0.456 . . . . 0.0 110.354 -179.964 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -89.56 164.08 14.93 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.236 -179.702 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -62.9 -36.74 84.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.079 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -68.23 -9.21 45.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.712 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.434 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -102.6 -1.77 29.67 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.479 -179.615 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.6 t -87.57 -35.08 7.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.15 -179.761 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.535 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.6 tm-20 -60.41 -49.6 89.58 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.504 -179.679 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.535 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 71.7 Cg_exo -48.19 -50.48 11.94 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.041 1.827 . . . . 0.0 111.993 179.548 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 73' ' ' ALA . 11.0 mt -57.86 -30.22 65.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.777 -179.381 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 31.4 mm -62.43 -59.1 4.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -70.08 -36.09 74.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.744 0.307 . . . . 0.0 111.485 -179.423 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.671 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -54.6 -55.42 29.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.171 -179.176 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.725 HD13 HD22 ' A' ' 92' ' ' LEU . 16.7 mt -53.91 -12.25 0.54 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.721 0.296 . . . . 0.0 111.188 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -114.29 -15.46 12.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.375 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.1 -41.2 96.25 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.329 0.585 . . . . 0.0 111.256 -179.281 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.664 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 24.1 t70 61.11 28.25 17.97 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.778 -179.845 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.506 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 56.4 m -82.14 1.11 37.74 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.119 -179.334 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.59 -86.78 1.54 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.528 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -62.65 -44.06 97.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.04 0.448 . . . . 0.0 110.26 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.671 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.8 t -71.2 -39.93 73.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.158 -179.896 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.664 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 5.2 ttm180 -68.29 -62.27 1.47 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.688 179.987 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.8 t -53.7 -26.43 22.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.802 179.561 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.34 -46.87 91.34 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.933 179.596 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.452 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -66.93 -28.58 68.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.702 0.286 . . . . 0.0 110.976 179.516 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.58 -43.89 96.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.815 -179.701 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 3.8 ptp180 -83.05 -37.08 24.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.826 179.808 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.6 m -53.22 -41.31 65.22 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.099 179.887 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 73' ' ' ALA . 78.4 mt -55.4 -59.32 4.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.888 0.375 . . . . 0.0 110.138 179.049 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -51.88 -32.65 33.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.811 178.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 23.9 mt-30 -66.42 -31.09 71.64 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-O 120.945 0.402 . . . . 0.0 110.366 179.652 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.62 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 90.6 mt -75.91 -61.54 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.464 -179.721 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 57.81 110.63 0.01 OUTLIER Glycine 0 CA--C 1.52 0.389 0 C-N-CA 120.995 -0.622 . . . . 0.0 113.157 179.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 150.82 -165.65 30.2 Favored Glycine 0 C--N 1.33 0.25 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.723 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.577 ' HG3' HH21 ' A' ' 86' ' ' ARG . 1.9 mp0 -72.21 -40.59 67.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.94 0.4 . . . . 0.0 110.643 179.735 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.51 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -54.75 -50.98 67.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.476 179.681 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.51 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 9.9 p -70.85 -27.12 29.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.072 179.4 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.577 HH21 ' HG3' ' A' ' 83' ' ' GLU . 7.4 ttp180 -58.66 -30.49 67.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.933 -178.764 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.63 -23.37 27.55 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.79 0.292 . . . . 0.0 111.79 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.5 -37.68 71.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.44 -179.327 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.434 ' SD ' HD23 ' A' ' 108' ' ' LEU . 9.8 ptt? -72.0 -36.7 69.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.55 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -68.38 -45.27 73.18 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.502 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -60.82 -24.92 66.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.708 179.576 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.725 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -86.45 -33.84 20.28 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.403 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.68 -15.23 57.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.062 179.822 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -84.37 -30.3 25.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.94 179.522 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.5 p -119.82 21.56 11.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.394 179.415 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -50.72 127.0 26.71 Favored Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 114.923 -1.035 . . . . 0.0 113.612 -178.896 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 t -144.22 130.17 19.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.751 179.015 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 57.89 -152.31 28.06 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.758 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.468 ' HB3' HH12 ' A' ' 70' ' ' ARG . 49.9 t80 -52.77 -33.13 47.21 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.655 0.264 . . . . 0.0 111.348 -179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.604 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -52.3 -40.31 61.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.741 -179.571 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 -71.78 -52.84 15.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.604 -179.597 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -45.61 -26.48 0.61 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.244 0.545 . . . . 0.0 110.51 -179.79 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 99' ' ' PHE . 45.6 t -66.93 -57.81 8.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.46 179.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.607 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -54.62 -62.17 1.83 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.943 0.719 . . . . 0.0 112.943 -179.135 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.684 HG13 HD22 ' A' ' 106' ' ' ASN . 7.5 p -53.88 -47.1 64.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.721 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.684 HD22 HG13 ' A' ' 105' ' ' VAL . 0.9 OUTLIER -70.79 -35.55 72.61 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.271 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -64.9 -26.18 68.21 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 120.817 0.341 . . . . 0.0 111.385 -178.238 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.434 HD23 ' SD ' ' A' ' 89' ' ' MET . 39.7 mt -49.98 -26.65 4.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.295 179.715 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.53 -6.2 0.67 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.226 -179.399 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 p -114.8 -74.23 0.62 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 13.0 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.916 -179.834 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.471 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.458 -0.048 0 CA-C-O 120.776 0.322 . . . . 0.0 110.709 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.506 ' CE2' ' HB3' ' A' ' 53' ' ' ARG . 1.1 t80 -59.15 -53.17 61.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.515 179.453 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.453 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 4.2 mm-40 -63.51 -57.13 21.21 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.629 179.106 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.471 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 32.9 Cg_exo -50.06 -21.96 7.16 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 121.993 1.795 . . . . 0.0 110.892 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.671 HD21 HG13 ' A' ' 46' ' ' ILE . 1.3 tp -79.31 -42.89 24.71 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 114.632 -1.167 . . . . 0.0 109.87 179.717 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.621 HD12 HD12 ' A' ' 31' ' ' LEU . 18.5 tp -75.6 -21.06 58.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.108 178.844 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 15.4 mm-40 -76.45 -40.69 49.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.519 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.403 ' O ' ' HB3' ' A' ' 33' ' ' ASN . 72.6 p -66.24 -16.29 63.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.491 -179.83 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.621 HD12 HD12 ' A' ' 28' ' ' LEU . 78.2 mt -65.71 -8.71 22.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.727 0.298 . . . . 0.0 111.129 179.955 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.4 t -95.08 8.96 41.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.733 179.71 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.632 HD21 ' HB3' ' A' ' 35' ' ' ASP . 0.8 OUTLIER -81.08 128.84 34.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.169 -179.808 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.17 -27.11 65.37 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.276 -179.084 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.632 ' HB3' HD21 ' A' ' 33' ' ' ASN . 36.7 t70 -75.85 163.0 27.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.793 0.33 . . . . 0.0 111.075 -179.59 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 13.5 p90 -107.67 -31.89 7.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.29 -179.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -59.72 -39.03 83.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.0 mt -80.52 -44.75 21.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.828 179.841 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -65.12 -19.56 66.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.741 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.76 -66.44 2.63 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.531 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.1 -35.78 7.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.795 0.331 . . . . 0.0 111.206 179.755 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.2 -49.45 77.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.54 179.622 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.406 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -68.12 -34.55 76.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.783 179.452 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -67.23 -27.86 67.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.012 -179.234 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.6 mt -99.16 -28.79 3.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.78 0.324 . . . . 0.0 111.617 -179.256 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.671 HG13 HD21 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -60.86 -28.7 43.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.176 -179.32 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -69.4 -24.73 75.98 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.27 179.666 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -64.68 -32.97 74.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.775 0.321 . . . . 0.0 110.463 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.469 ' C ' ' H ' ' A' ' 51' ' ' ASP . 17.8 m-85 -92.32 108.7 20.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.441 179.581 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -76.58 31.26 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.035 0.445 . . . . 0.0 111.005 179.885 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 49' ' ' PHE . 20.8 t70 -85.52 160.32 19.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.903 -179.931 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.98 -40.28 97.27 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.795 -179.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.506 ' HB3' ' CE2' ' A' ' 24' ' ' PHE . 39.6 ttm180 -65.33 -12.28 50.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.133 -179.839 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.52 ' O ' HD13 ' A' ' 58' ' ' LEU . . . -106.11 8.94 32.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.134 -179.143 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 51' ' ' ASP . 40.9 t -92.1 -41.73 13.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.213 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.515 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 5.8 tp10 -55.9 -49.17 94.49 Favored Pre-proline 0 C--N 1.331 -0.236 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.088 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.515 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 97.0 Cg_exo -44.24 -52.93 5.23 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.22 1.947 . . . . 0.0 112.055 -179.963 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 54' ' ' ALA . 6.8 mp -51.44 -40.32 59.15 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.888 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.9 mm -59.82 -60.83 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -70.06 -22.35 63.08 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -179.233 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.686 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -76.23 -44.92 35.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -177.966 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.71 ' HB3' HD11 ' A' ' 92' ' ' LEU . 31.3 mt -62.21 -9.2 7.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.117 0.484 . . . . 0.0 110.698 -179.032 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -127.38 -2.54 6.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.652 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.483 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 47.7 t0 -61.36 -33.89 74.39 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.338 -179.766 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.659 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 3.7 m-20 59.79 25.68 14.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.796 -179.548 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.533 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.9 m -86.29 8.65 20.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.42 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 74.31 -94.31 0.82 Allowed Glycine 0 C--N 1.333 0.361 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.701 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.66 -42.19 78.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.975 0.417 . . . . 0.0 110.502 179.892 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.686 HG12 ' HG ' ' A' ' 61' ' ' LEU . 25.7 t -71.66 -33.19 48.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.726 -179.666 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.659 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 47.6 ttt180 -73.26 -61.23 1.89 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.01 -179.934 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.2 m -51.65 -30.17 20.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.993 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.51 -43.7 95.84 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.35 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.533 ' HA ' ' HB2' ' A' ' 76' ' ' SER . . . -72.35 -34.04 67.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.795 0.331 . . . . 0.0 110.832 179.718 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.515 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -53.65 -44.11 69.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.567 179.759 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.4 ptp85 -83.02 -28.2 29.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.367 179.348 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.533 ' HB2' ' HA ' ' A' ' 73' ' ' ALA . 58.7 m -62.29 -20.98 64.86 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.189 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.567 HD21 HD11 ' A' ' 62' ' ' LEU . 4.9 mt -66.34 -61.26 2.1 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.734 0.302 . . . . 0.0 110.437 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -61.45 -22.28 64.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.761 178.685 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.511 ' HB2' ' HA ' ' A' ' 76' ' ' SER . 0.0 OUTLIER -65.74 -37.85 87.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.165 179.307 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.506 ' HB ' HG21 ' A' ' 85' ' ' VAL . 77.6 mt -87.61 -60.89 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.085 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.66 125.59 0.02 OUTLIER Glycine 0 C--N 1.331 0.258 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.847 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 147.08 -174.13 26.99 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.992 179.743 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -72.21 -22.11 61.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.939 0.4 . . . . 0.0 111.097 -179.889 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.587 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -71.18 -46.75 60.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.872 -179.935 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.55 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 12.1 t -70.73 -26.64 28.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.447 179.898 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ppt_? -58.69 -20.03 44.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.445 -179.528 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -82.29 -30.56 30.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.595 179.457 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.25 -40.32 74.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.194 179.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.502 ' O ' ' HB1' ' A' ' 104' ' ' ALA . 16.1 ptt? -71.18 -39.18 72.0 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.723 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -64.73 -26.65 68.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.988 0.423 . . . . 0.0 109.899 179.028 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -64.72 -48.01 76.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.23 179.325 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.71 HD11 ' HB3' ' A' ' 62' ' ' LEU . 54.5 mt -68.49 -35.07 77.0 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.403 179.39 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.477 ' HA ' ' CZ ' ' A' ' 101' ' ' ARG . . . -55.18 -33.56 63.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.834 179.058 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -96.99 -11.92 23.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.155 179.681 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.1 m -92.24 -28.62 16.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.951 0.405 . . . . 0.0 111.065 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 62.7 113.3 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.62 -179.642 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.619 ' H ' ' HB2' ' A' ' 101' ' ' ARG . 14.1 p -146.56 -176.58 5.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.734 0.302 . . . . 0.0 111.032 -179.533 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -83.69 -83.71 0.92 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.512 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.442 ' O ' HG23 ' A' ' 103' ' ' VAL . 58.2 t80 -78.52 -40.35 35.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.746 0.307 . . . . 0.0 111.01 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.414 ' HB3' ' OG1' ' A' ' 97' ' ' THR . . . -57.01 -43.32 81.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.651 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.619 ' HB2' ' H ' ' A' ' 97' ' ' THR . 23.8 tpt85 -59.9 -61.39 2.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.497 -179.384 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 54.2 tttt -50.13 -37.37 33.92 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.174 0.511 . . . . 0.0 110.118 179.63 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.515 HG21 ' HB1' ' A' ' 74' ' ' ALA . 11.9 t -61.5 -41.86 91.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.902 179.369 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.502 ' HB1' ' O ' ' A' ' 89' ' ' MET . . . -64.88 -59.75 3.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.139 -179.473 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.451 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 4.4 p -58.96 -47.16 90.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.819 -178.969 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.437 ' N ' HG13 ' A' ' 105' ' ' VAL . 37.0 t30 -64.67 -32.57 74.29 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.559 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -62.45 -26.92 68.77 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 120.666 0.27 . . . . 0.0 111.143 -178.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -51.94 -26.2 9.9 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.25 179.766 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -55.35 -18.37 6.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.284 179.887 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.423 HG22 ' CD2' ' A' ' 111' ' ' HIS . 9.0 m -101.99 -74.72 0.62 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.936 -179.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.423 ' CD2' HG22 ' A' ' 110' ' ' THR . 94.3 m-70 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.69 179.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.406 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 CA--C 1.528 0.106 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.462 ' CE1' ' HB3' ' A' ' 53' ' ' ARG . 2.1 t80 -57.96 -51.34 70.06 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.3 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.457 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -63.37 -57.8 18.56 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.231 179.508 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HD3' ' HB2' ' A' ' 25' ' ' GLU . 83.3 Cg_exo -46.57 -25.2 3.3 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 122.065 1.843 . . . . 0.0 111.467 -179.706 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 19.7 mt -77.5 -46.54 22.12 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.894 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.625 HD12 HD12 ' A' ' 31' ' ' LEU . 27.3 tp -68.47 -19.8 64.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.918 178.855 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.58 -23.82 53.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.469 179.824 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.5 m -66.39 -24.08 66.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.132 -179.675 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.625 HD12 HD12 ' A' ' 28' ' ' LEU . 85.3 mt -65.34 -10.77 35.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.842 0.353 . . . . 0.0 110.643 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.6 t -88.67 8.37 28.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.534 179.851 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -102.32 130.04 48.94 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.33 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -68.27 -4.03 12.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.966 179.366 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -77.6 150.54 34.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.734 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 46.9 m0 -88.04 -46.25 9.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.965 -179.973 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -60.29 -37.22 79.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.238 -179.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.9 mt -75.03 -57.28 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.244 -179.781 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.564 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 24.7 ttm180 -59.03 -23.22 61.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.066 -179.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.402 ' HA2' ' HA ' ' A' ' 69' ' ' VAL . . . -77.06 -59.07 3.24 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.767 -179.741 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.69 8.37 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.763 0.316 . . . . 0.0 111.502 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.82 -56.53 20.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.769 179.741 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.454 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -65.79 -35.37 80.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.833 179.359 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -55.37 -33.37 63.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.673 -179.582 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.47 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 46.7 mm -99.5 -23.04 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.244 0.545 . . . . 0.0 110.758 -179.835 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.623 HG23 ' HB1' ' A' ' 54' ' ' ALA . 1.0 OUTLIER -60.04 -32.53 50.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.767 -179.209 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.59 -22.2 77.87 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.608 -0.806 . . . . 0.0 113.092 -179.31 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.47 ' ND2' ' HA ' ' A' ' 45' ' ' ILE . 32.1 m-80 -70.74 -8.12 49.87 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.19 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -94.97 -26.81 15.95 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.566 ' HG3' HD12 ' A' ' 80' ' ' ILE . 19.2 mp0 57.76 30.52 19.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.995 0.426 . . . . 0.0 111.005 -179.577 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.412 ' O ' HG23 ' A' ' 55' ' ' VAL . 23.6 t70 -102.43 161.02 14.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.995 -179.822 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -62.44 -37.98 88.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.066 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.462 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 17.9 ttm180 -67.09 -9.0 34.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.586 179.741 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.623 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -103.74 -9.63 18.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.86 -179.26 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 51' ' ' ASP . 68.1 t -82.91 -35.16 12.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.245 -179.827 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.607 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 26.9 tt0 -60.27 -51.37 80.72 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.778 -179.454 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.607 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 54.1 Cg_exo -52.5 -34.86 64.03 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.148 1.898 . . . . 0.0 112.595 179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.537 ' HA ' ' HB2' ' A' ' 73' ' ' ALA . 8.7 mt -72.18 -27.27 62.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.202 -179.339 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 33.3 mm -63.05 -59.75 3.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.315 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -70.03 -7.02 37.63 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -178.342 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.764 ' HG ' HG12 ' A' ' 69' ' ' VAL . 3.1 mp -89.84 -40.57 12.35 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -177.997 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.833 HD11 HD11 ' A' ' 77' ' ' LEU . 4.3 mt -59.68 -14.81 15.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.278 0.561 . . . . 0.0 110.244 -178.888 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -104.46 -27.93 11.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.441 179.136 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.46 ' O ' ' HB2' ' A' ' 70' ' ' ARG . 34.2 t70 -59.77 138.31 57.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.853 -179.765 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -110.74 39.04 2.32 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.043 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 67.2 m -86.49 -30.68 21.79 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.283 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 115.54 -92.06 0.57 Allowed Glycine 0 C--N 1.329 0.175 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.032 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -57.96 -31.55 66.99 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.191 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.764 HG12 ' HG ' ' A' ' 61' ' ' LEU . 22.7 t -69.16 -51.2 45.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.05 179.829 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 57.9 ttp180 -61.02 -58.59 7.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.641 -179.816 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 63.9 m -51.05 -27.09 7.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.867 -179.043 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.61 -56.04 26.73 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.292 179.902 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.537 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . . . -60.2 -38.66 83.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.909 0.336 . . . . 0.0 111.909 179.767 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.05 -44.42 67.42 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -178.71 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.46 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 7.7 ptp180 -84.57 -35.42 22.81 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.269 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.523 ' HA ' HE21 ' A' ' 79' ' ' GLN . 67.4 m -63.39 -36.05 82.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.048 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.833 HD11 HD11 ' A' ' 62' ' ' LEU . 34.5 mt -61.76 -61.07 2.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.571 0.224 . . . . 0.0 111.221 -179.902 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.434 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 38.1 tt0 -62.25 -19.9 63.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.049 0.452 . . . . 0.0 110.395 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.523 HE21 ' HA ' ' A' ' 76' ' ' SER . 8.2 tt0 -62.83 -25.22 68.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.498 179.668 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.566 HD12 ' HG3' ' A' ' 50' ' ' GLN . 2.5 mm -90.79 -60.14 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.056 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.03 98.27 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.775 -0.648 . . . . 0.0 112.46 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 169.35 -174.15 43.73 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.46 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -70.93 -23.85 62.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.736 0.303 . . . . 0.0 110.673 -179.856 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.504 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -62.7 -53.16 58.72 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.646 179.866 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.697 HG13 HD22 ' A' ' 77' ' ' LEU . 93.6 t -70.65 -24.69 25.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.943 0.401 . . . . 0.0 110.692 179.217 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.3 -27.48 35.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.615 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.86 -30.21 23.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.442 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.13 -38.85 72.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.242 179.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.818 ' HE2' HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -68.64 -32.84 72.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.671 179.434 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -64.9 -42.51 94.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.316 179.3 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -58.73 -38.17 77.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.084 179.793 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.644 HD22 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -86.54 -23.11 25.97 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.462 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.27 -21.32 62.11 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.528 179.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.47 -26.03 38.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.684 179.591 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 82.4 p -119.59 22.93 11.44 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.248 178.775 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -54.38 123.3 27.48 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.009 -0.996 . . . . 0.0 113.594 -178.781 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.0 t -145.95 130.04 17.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.46 -0.37 . . . . 0.0 110.684 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.09 -139.07 47.99 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.066 -0.588 . . . . 0.0 112.879 -179.76 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -60.8 -31.55 70.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.811 0.338 . . . . 0.0 111.088 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.578 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -54.1 -42.52 69.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.913 -179.404 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -67.11 -58.49 4.78 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -178.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.0 ttmp? -45.52 -30.04 1.33 Allowed 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.046 0.451 . . . . 0.0 110.885 -179.497 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.477 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 12.2 t -60.24 -57.08 13.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.236 179.511 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.624 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -63.74 -53.59 48.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.283 -179.194 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.8 t -61.28 -62.01 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -178.195 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -55.61 -29.4 59.08 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -178.124 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.434 ' CE1' ' HA ' ' A' ' 78' ' ' GLU . 3.0 t80 -58.84 -32.96 69.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.927 0.394 . . . . 0.0 110.635 -179.479 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.818 HD11 ' HE2' ' A' ' 89' ' ' MET . 37.6 mt -55.28 -23.44 23.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.606 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.98 6.66 8.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.599 -179.826 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.7 m -126.44 -74.93 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.428 -179.863 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.579 -179.959 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.627 0.251 . . . . 0.0 111.378 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.555 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 4.7 t80 -53.91 -53.8 47.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.692 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -63.55 -56.06 29.51 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.362 179.0 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.497 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 83.7 Cg_exo -45.34 -27.52 3.2 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.118 1.879 . . . . 0.0 111.821 179.593 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.596 HD13 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -64.89 -59.14 4.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.756 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 25' ' ' GLU . 4.2 pp -68.53 -19.23 64.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.109 0.48 . . . . 0.0 110.161 178.993 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.455 ' N ' HD12 ' A' ' 28' ' ' LEU . 40.3 tt0 -69.65 -34.69 74.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.453 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.7 t -66.42 -14.99 62.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.383 -179.827 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.538 HD11 ' HG3' ' A' ' 57' ' ' PRO . 95.9 mt -65.65 -10.26 34.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.804 0.335 . . . . 0.0 110.801 179.858 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.3 m -113.61 12.61 18.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.065 -179.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -78.68 143.05 36.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.847 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -67.79 -25.41 65.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.06 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -87.56 135.06 33.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.953 -179.965 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 27.9 p-90 -82.24 -35.22 28.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.991 -179.897 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.451 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 40.7 ttp180 -58.73 -30.7 67.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.151 179.785 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.0 mm -82.79 -41.19 17.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.353 179.884 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.459 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 39.6 ttm180 -63.63 -40.14 96.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.553 -179.362 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.527 ' HA2' HG13 ' A' ' 69' ' ' VAL . . . -59.09 -60.55 8.67 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.3 -179.892 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.12 -27.79 2.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.638 0.256 . . . . 0.0 111.317 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 39' ' ' ARG . . . -58.94 -56.33 23.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.839 179.611 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.511 ' HB1' HD23 ' A' ' 58' ' ' LEU . . . -68.94 -25.33 64.5 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.758 0.313 . . . . 0.0 111.215 179.946 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.6 m95 -55.44 -44.96 76.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.054 -179.453 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.9 mm -99.95 -21.07 5.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.022 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.634 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.9 tt -58.21 -30.77 40.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.765 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.494 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -65.39 -16.72 63.2 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.955 -179.399 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.65 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.7 OUTLIER -70.81 -25.04 62.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.641 0.258 . . . . 0.0 111.617 -179.573 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -72.18 -23.63 61.3 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.721 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 56.84 26.21 11.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.932 0.396 . . . . 0.0 111.425 179.83 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -101.99 160.54 14.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.218 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.533 ' O ' HG22 ' A' ' 55' ' ' VAL . 9.8 pt-20 -65.58 -34.14 77.54 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.247 0.546 . . . . 0.0 110.62 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 18.7 ttm180 -69.36 -10.24 57.01 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.415 179.204 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.418 ' C ' ' HD2' ' A' ' 57' ' ' PRO . . . -104.11 -21.07 13.63 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.795 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.533 HG22 ' O ' ' A' ' 52' ' ' GLU . 19.4 m -76.61 -35.99 26.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.113 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.588 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 31.7 tt0 -57.8 -51.88 78.5 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 111.49 0.181 . . . . 0.0 111.49 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.634 ' HG2' HD13 ' A' ' 46' ' ' ILE . 66.6 Cg_exo -52.03 -23.43 16.99 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.131 1.888 . . . . 0.0 112.151 179.399 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.554 HD22 ' HA ' ' A' ' 73' ' ' ALA . 50.6 mt -80.02 -35.97 36.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.496 179.713 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.24 -54.27 37.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.028 -179.588 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -70.12 -14.43 62.65 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -178.366 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.734 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 tp -90.05 -27.45 19.7 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.442 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.632 HD11 HD11 ' A' ' 77' ' ' LEU . 10.1 mt -65.81 -9.77 31.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.139 0.495 . . . . 0.0 110.475 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -121.7 1.8 10.01 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.071 -179.683 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -61.01 -32.15 71.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.19 0.519 . . . . 0.0 111.289 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 52.47 28.65 6.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.333 -0.849 . . . . 0.0 112.02 179.833 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.498 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 7.4 t -85.33 -25.45 27.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.983 0.421 . . . . 0.0 110.818 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.65 -108.83 0.99 Allowed Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.966 -179.832 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.451 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.9 OUTLIER -59.7 -27.46 66.45 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.974 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.734 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.8 t -66.99 -34.54 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.932 178.968 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -75.73 -49.33 18.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.994 179.16 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 56.7 m -67.1 -21.37 65.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.996 179.414 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -62.74 -63.39 4.67 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.301 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.554 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -55.23 -25.77 35.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.879 0.371 . . . . 0.0 111.124 179.348 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.49 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.78 -58.28 8.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.55 -179.63 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -64.6 -37.59 88.1 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.324 -179.729 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.494 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 38.6 m -55.79 -38.38 69.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.208 -179.694 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.632 HD11 HD11 ' A' ' 62' ' ' LEU . 15.8 mt -69.73 -60.02 2.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.666 179.303 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.433 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 29.9 mt-10 -51.7 -25.93 8.29 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.245 0.545 . . . . 0.0 109.927 178.436 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' A' ' 76' ' ' SER . 6.3 tt0 -70.11 -44.09 69.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.904 179.164 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.447 ' HB ' HG11 ' A' ' 85' ' ' VAL . 79.9 mt -57.59 -58.43 6.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.201 178.901 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.495 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 70.29 135.41 0.1 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.915 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 124.73 174.81 14.11 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.828 179.685 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -61.79 -22.91 65.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.989 0.423 . . . . 0.0 110.551 179.562 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.563 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -55.13 -63.21 1.23 Allowed 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.829 -179.896 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.447 HG11 ' HB ' ' A' ' 80' ' ' ILE . 5.2 m -70.28 -24.55 25.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.815 179.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -55.86 -28.71 57.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.498 -178.566 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.19 -26.44 26.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.861 0.363 . . . . 0.0 110.706 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.48 -46.18 60.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.087 179.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.58 ' HE2' ' N ' ' A' ' 89' ' ' MET . 0.0 OUTLIER -72.11 -37.45 69.52 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 179.828 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -55.56 -37.15 67.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.95 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -81.52 -20.96 38.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.901 179.328 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.555 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -83.21 -26.13 31.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.663 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.66 -24.85 67.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.728 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -80.04 -22.7 42.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.293 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 30.2 p -120.39 15.93 12.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.173 179.227 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -56.33 127.55 43.92 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 114.794 -1.093 . . . . 0.0 113.468 -178.936 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.0 t -139.78 130.3 25.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.963 0.411 . . . . 0.0 110.55 178.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.6 -132.03 51.29 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.705 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -69.49 -33.92 73.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.635 0.255 . . . . 0.0 111.589 -179.716 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.473 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -49.79 -33.01 15.28 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.008 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.404 ' C ' ' N ' ' A' ' 103' ' ' VAL . 49.9 ttp180 -79.76 -52.52 7.82 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -178.823 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -45.91 -23.24 0.27 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.263 0.554 . . . . 0.0 110.429 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.49 HG21 ' HB1' ' A' ' 74' ' ' ALA . 55.6 t -71.47 -60.24 2.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.341 179.664 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.542 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -54.06 -49.95 67.85 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.208 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.0 t -64.87 -63.23 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.215 -0.902 . . . . 0.0 113.008 -177.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -55.39 -46.29 76.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.626 -178.379 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.495 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 39.2 t80 -60.0 -37.54 80.02 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.196 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.579 ' O ' HD12 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -49.82 -25.31 2.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.373 -178.116 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.2 6.27 1.02 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.683 -179.767 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 76.8 p -96.4 -71.24 0.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.595 0.236 . . . . 0.0 111.445 -179.887 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 62.4 t-80 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.805 179.964 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.593 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.231 0.093 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.531 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -61.04 -51.12 70.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.984 0.421 . . . . 0.0 110.584 179.904 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -62.94 -52.99 59.5 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.1 179.806 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.593 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 74.3 Cg_exo -40.61 -28.93 0.36 Allowed 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 122.257 1.972 . . . . 0.0 111.722 179.285 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 49.2 mt -72.64 -55.04 7.46 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.101 178.714 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.698 HD12 HD12 ' A' ' 31' ' ' LEU . 23.8 tp -63.09 -22.9 67.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.167 179.021 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -83.18 -34.17 26.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.996 179.763 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.3 t -66.23 -16.18 63.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.901 179.772 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.698 HD12 HD12 ' A' ' 28' ' ' LEU . 80.3 mt -63.4 -13.22 37.42 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.877 -179.999 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 90.3 p -100.64 22.34 12.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.773 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.01 146.18 27.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.963 -179.827 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -66.44 -20.9 66.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.385 -179.784 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -83.87 162.8 20.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.379 . . . . 0.0 111.176 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 14.5 p90 -103.11 -40.34 6.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.175 -179.997 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -61.72 -30.34 70.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.137 -179.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 31.8 mm -78.51 -42.05 25.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.452 -179.431 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.445 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 41.6 ttm180 -62.96 -44.7 95.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.302 -179.632 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.24 -57.92 12.05 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.892 -179.679 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.89 -28.9 4.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.718 0.294 . . . . 0.0 111.582 -179.811 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.439 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -63.7 -50.56 68.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.951 179.862 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.57 ' CB ' HD22 ' A' ' 61' ' ' LEU . . . -74.82 -25.23 58.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.432 -179.893 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -60.63 -37.98 83.25 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.408 -179.878 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.2 mm -99.53 -19.77 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.799 -179.397 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.469 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.3 tt -59.81 -36.79 68.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -178.417 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.445 ' HA2' HD11 ' A' ' 80' ' ' ILE . . . -70.97 -7.44 62.27 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.465 -0.874 . . . . 0.0 113.39 -179.099 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.556 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.9 OUTLIER -70.78 -26.45 63.34 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -179.241 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -87.03 -27.03 23.44 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.813 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.571 ' HG3' HD13 ' A' ' 80' ' ' ILE . 1.1 mp0 60.74 60.94 1.78 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.76 0.314 . . . . 0.0 111.524 -179.607 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -127.99 176.95 7.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.787 179.47 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -64.22 -34.23 77.61 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.931 179.777 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.523 ' HE ' ' HA ' ' A' ' 53' ' ' ARG . 1.8 mmp_? -68.56 -11.44 59.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.252 -179.899 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.39 10.38 33.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.956 -179.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.5 t -91.54 -58.49 3.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.056 -179.275 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.434 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 39.4 tt0 -60.5 -46.28 97.37 Favored Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.094 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.543 ' HG3' HD13 ' A' ' 28' ' ' LEU . 95.2 Cg_exo -43.67 -48.08 9.07 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.191 1.927 . . . . 0.0 112.647 -179.898 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.486 HD22 ' HA ' ' A' ' 73' ' ' ALA . 10.3 mt -59.74 -36.51 76.76 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.276 -179.477 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.695 HD11 ' HB1' ' A' ' 88' ' ' ALA . 40.2 mm -61.39 -61.15 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.181 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.527 ' HD2' HD13 ' A' ' 31' ' ' LEU . 5.9 ptpt -70.25 -11.91 61.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.978 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.656 HD23 ' H ' ' A' ' 73' ' ' ALA . 1.3 tp -89.97 -45.75 8.98 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -177.821 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.491 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 3.9 pp -67.26 -8.38 31.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 111.291 -178.438 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -101.71 -4.32 26.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.189 -179.877 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.436 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 2.1 m-20 -61.3 -33.85 74.25 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.61 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.616 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 38.4 m-20 59.6 27.58 16.82 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.183 -179.35 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.491 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 11.7 m -82.12 -31.83 30.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.59 -179.335 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 135.78 -109.36 0.74 Allowed Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.792 -179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -58.14 -28.71 64.95 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.757 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.491 ' HB ' ' HB2' ' A' ' 66' ' ' SER . 49.4 t -65.5 -45.9 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.477 178.688 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.616 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 53.0 ttp180 -62.0 -48.88 78.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.389 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.9 m -67.12 -24.8 65.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.205 -179.993 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -55.37 -69.78 1.16 Allowed Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.386 -179.903 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.656 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -47.56 -31.98 4.94 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 179.295 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.86 -47.64 84.1 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.26 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -71.29 -40.3 70.95 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.157 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.596 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 6.7 p -54.46 -27.85 40.37 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.692 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.659 ' HB3' HG11 ' A' ' 85' ' ' VAL . 17.6 mt -55.12 -60.69 3.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.743 0.306 . . . . 0.0 110.696 179.944 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 34.2 mt-10 -48.88 -36.9 18.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.989 178.262 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.596 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 22.1 mt-30 -67.3 -30.4 70.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.855 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.571 HD13 ' HG3' ' A' ' 50' ' ' GLN . 50.6 mm -80.1 -60.48 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.337 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.597 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . 150.45 142.89 3.63 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.479 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 86' ' ' ARG . . . -69.27 -50.03 35.66 Favored Glycine 0 C--O 1.223 -0.569 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.16 -179.475 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -55.27 -35.94 65.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.586 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.597 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.0 OUTLIER -86.2 -58.59 2.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.005 0.431 . . . . 0.0 111.484 -179.046 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.659 HG11 ' HB3' ' A' ' 77' ' ' LEU . 75.7 t -60.09 -21.75 22.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.734 -179.489 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 12.1 ttp180 -52.95 -31.17 38.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.926 0.393 . . . . 0.0 110.608 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.05 -33.29 70.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.775 179.219 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.695 ' HB1' HD11 ' A' ' 59' ' ' ILE . . . -71.58 -46.27 59.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.441 179.444 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.621 ' HE3' HD23 ' A' ' 92' ' ' LEU . 24.8 mmm -63.08 -48.95 76.42 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.819 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -51.27 -33.27 27.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.617 178.829 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 60.7 tptt -79.03 -26.41 43.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.0 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.625 HD21 ' O ' ' A' ' 100' ' ' ALA . 2.0 tp -82.29 -25.55 33.89 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.566 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.93 -22.5 65.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.269 0.557 . . . . 0.0 109.604 178.897 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -80.25 -29.75 38.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.556 179.041 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 15.5 p -108.61 19.05 20.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.673 178.97 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.508 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -51.51 114.14 2.82 Favored Glycine 0 N--CA 1.447 -0.597 0 CA-C-N 115.237 -0.892 . . . . 0.0 113.235 -179.117 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.0 t -139.8 130.1 25.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.857 0.36 . . . . 0.0 110.799 179.348 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.29 -127.85 44.59 Favored Glycine 0 CA--C 1.519 0.326 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.862 179.929 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.485 ' O ' HG23 ' A' ' 103' ' ' VAL . 24.6 t80 -74.04 -31.52 62.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.71 0.29 . . . . 0.0 111.278 -179.808 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.625 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.66 -37.05 48.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.032 -179.248 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.508 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 29.6 ttt180 -67.37 -58.61 4.46 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.371 -179.535 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -47.03 -24.77 0.68 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.788 -179.973 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 55.6 t -66.01 -60.67 2.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.506 179.846 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.584 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -59.26 -39.66 83.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.901 -179.559 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 38.5 t -64.94 -58.22 8.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.69 -0.687 . . . . 0.0 112.445 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.577 ' N ' HD22 ' A' ' 106' ' ' ASN . 0.8 OUTLIER -68.76 -43.33 76.01 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -178.03 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.553 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 62.6 t80 -60.83 -45.6 93.83 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -178.41 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.504 ' HB3' ' O ' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -50.13 -19.66 0.81 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.709 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -71.27 6.58 1.64 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.765 179.423 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 26.5 p -92.91 -40.46 10.59 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.017 0.436 . . . . 0.0 110.109 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.985 179.333 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.668 0.271 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.8 t80 -55.33 -53.19 59.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.333 179.5 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.39 -57.05 21.94 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.573 178.996 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.515 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 96.4 Cg_exo -41.74 -33.2 1.84 Allowed 'Trans proline' 0 C--N 1.359 1.109 0 C-N-CA 122.321 2.014 . . . . 0.0 111.607 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 22.8 mt -61.93 -58.25 8.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.927 178.706 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.735 HD12 HD12 ' A' ' 31' ' ' LEU . 11.0 tp -64.75 -21.15 66.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.911 178.693 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -74.38 -33.16 62.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.258 179.828 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.1 m -66.44 -17.34 64.73 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.753 -179.753 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.735 HD12 HD12 ' A' ' 28' ' ' LEU . 81.8 mt -65.49 -6.75 11.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.838 0.352 . . . . 0.0 110.804 179.852 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 53.1 m -121.62 17.07 11.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.356 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.483 HD21 ' HB3' ' A' ' 35' ' ' ASP . 11.4 t30 -88.04 137.19 32.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.858 -179.785 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -53.28 -37.48 62.23 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.584 -179.575 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.483 ' HB3' HD21 ' A' ' 33' ' ' ASN . 16.9 t70 -76.09 133.65 40.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.705 -179.672 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -92.03 -27.27 17.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.363 -179.559 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 -60.61 -36.17 77.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.139 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.8 mt -81.91 -38.92 16.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.17 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.484 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.6 ttm180 -56.43 -26.07 52.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.597 179.85 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.42 -63.27 3.46 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.219 179.723 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.412 ' HA ' ' HB2' ' A' ' 44' ' ' TRP . . . -48.82 -24.36 1.41 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.791 0.329 . . . . 0.0 111.346 179.787 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.426 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.98 -57.17 13.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.348 -179.957 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.16 -24.75 62.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.89 0.376 . . . . 0.0 111.195 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.437 ' NE1' ' HA2' ' A' ' 72' ' ' GLY . 6.5 m95 -55.42 -44.69 76.5 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.253 -178.884 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.4 mt -99.11 -20.4 5.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.755 0.312 . . . . 0.0 111.706 -179.381 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.596 HD13 ' HG2' ' A' ' 57' ' ' PRO . 1.4 tt -55.48 -34.12 33.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.681 -179.086 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.23 -27.57 72.55 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.783 -0.723 . . . . 0.0 113.334 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -70.73 -0.04 8.04 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.356 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -91.51 -38.22 12.66 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 -179.829 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.568 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.0 OUTLIER 69.57 44.96 0.84 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.272 0.558 . . . . 0.0 110.714 179.831 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.447 ' O ' HG23 ' A' ' 55' ' ' VAL . 4.9 m-20 -126.94 164.06 22.29 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.907 -179.843 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -61.57 -40.78 95.98 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.103 -179.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.503 ' HG3' HD22 ' A' ' 28' ' ' LEU . 14.0 ttm180 -67.25 -9.65 42.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.798 179.889 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.549 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -104.25 -8.89 19.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.14 -179.003 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 51' ' ' ASP . 71.2 t -91.72 -36.73 8.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.517 -179.767 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.608 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 13.5 tt0 -60.27 -51.93 76.74 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -179.395 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 51.0 Cg_exo -54.99 -17.67 14.87 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 122.273 1.982 . . . . 0.0 112.821 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.516 HD13 HD12 ' A' ' 77' ' ' LEU . 14.5 mt -85.82 -36.06 20.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.965 -179.76 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.6 mm -61.15 -53.34 50.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.801 -179.452 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -70.03 -13.71 62.35 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.88 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.677 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.9 mp -89.86 -36.36 15.11 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -177.961 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.572 HD13 HD22 ' A' ' 92' ' ' LEU . 9.0 mt -63.48 -9.16 11.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.836 0.351 . . . . 0.0 111.132 -178.34 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -111.78 -11.88 13.9 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.365 -179.823 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.424 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 3.0 t70 -61.07 -32.49 72.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.12 0.486 . . . . 0.0 111.111 179.978 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.4 t70 47.61 30.35 1.71 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.793 179.885 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.46 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 22.7 t -86.28 -36.26 19.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.864 0.364 . . . . 0.0 111.426 -179.767 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 130.2 -96.95 0.37 Allowed Glycine 0 C--O 1.228 -0.253 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 -178.875 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.06 -32.61 55.17 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.966 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.677 HG12 ' HG ' ' A' ' 61' ' ' LEU . 16.3 t -73.77 -59.99 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.032 179.286 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.418 ' HA ' ' O ' ' A' ' 61' ' ' LEU . 7.6 tmm_? -69.4 -63.33 1.09 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.675 -179.209 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 22.9 t -51.76 -24.89 6.51 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.005 0.431 . . . . 0.0 110.764 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.437 ' HA2' ' NE1' ' A' ' 44' ' ' TRP . . . -63.51 -61.25 6.43 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.699 -0.762 . . . . 0.0 111.714 179.347 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.51 -25.47 68.04 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.722 0.296 . . . . 0.0 110.973 179.243 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -52.42 -46.26 66.28 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.115 -179.366 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.468 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 11.5 ptp180 -81.34 -30.77 33.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.776 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.521 ' HA ' HE21 ' A' ' 79' ' ' GLN . 14.7 m -53.19 -44.14 67.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.353 -179.673 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.556 HD23 ' HE1' ' A' ' 89' ' ' MET . 9.0 mp -55.47 -59.61 4.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.836 179.766 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -52.37 -31.23 32.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.472 179.489 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.521 HE21 ' HA ' ' A' ' 76' ' ' SER . 34.0 mt-30 -62.95 -36.94 85.13 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.911 0.386 . . . . 0.0 110.395 179.631 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.568 HG23 ' HG3' ' A' ' 50' ' ' GLN . 69.2 mt -71.63 -55.2 14.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.543 179.432 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.564 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 63.12 -175.57 8.22 Favored Glycine 0 N--CA 1.453 -0.218 0 CA-C-N 115.979 -0.555 . . . . 0.0 113.383 179.407 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.595 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 73.49 168.35 14.98 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.349 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.445 ' HG3' HH21 ' A' ' 86' ' ' ARG . 40.2 tt0 -55.65 -21.12 16.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.927 0.394 . . . . 0.0 110.724 179.621 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.595 HH11 ' HA3' ' A' ' 82' ' ' GLY . 2.7 mpt_? -60.84 -65.6 0.66 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.242 -178.855 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.609 HG22 ' HE1' ' A' ' 89' ' ' MET . 2.5 p -70.88 -23.13 23.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.181 0.515 . . . . 0.0 110.105 179.492 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.445 HH21 ' HG3' ' A' ' 83' ' ' GLU . 23.2 ttp180 -54.61 -19.46 6.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.273 -179.815 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -79.56 -36.65 37.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.43 -35.87 72.76 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.606 179.607 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.609 ' HE1' HG22 ' A' ' 85' ' ' VAL . 8.4 mmt -59.23 -62.74 1.66 Allowed 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.86 178.987 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -51.56 -36.55 45.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.93 179.394 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -73.53 -28.16 61.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.589 -179.825 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.662 HD23 ' HB2' ' A' ' 104' ' ' ALA . 2.4 tp -86.19 -27.15 24.71 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.581 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.28 -28.28 64.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.684 179.039 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -80.14 -27.51 39.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.766 179.455 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.4 p -112.16 27.03 10.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.484 179.245 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.546 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -50.53 119.8 7.84 Favored Glycine 0 N--CA 1.448 -0.552 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.818 -178.852 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 t -142.58 130.68 21.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.521 -0.339 . . . . 0.0 110.42 179.05 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.92 -132.37 19.43 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.318 -179.567 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.07 -15.88 23.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.803 0.335 . . . . 0.0 110.588 179.998 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.454 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -56.93 -37.06 70.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.648 179.638 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.546 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 61.0 ttt180 -57.19 -61.28 2.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.343 179.458 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -53.32 -32.8 50.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.309 179.379 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.454 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 9.6 t -62.45 -51.94 66.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.499 179.974 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.662 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -56.15 -62.24 1.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -178.914 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 106' ' ' ASN . 6.0 p -57.77 -53.38 45.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.022 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.502 ' N ' HG13 ' A' ' 105' ' ' VAL . 41.2 t30 -61.83 -39.16 90.83 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -178.787 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.564 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 63.4 t80 -62.16 -23.96 66.9 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 120.836 0.35 . . . . 0.0 111.263 -178.613 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.2 mt -53.65 -22.78 9.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.411 -179.757 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -77.63 7.17 5.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.246 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.0 m -130.05 -52.97 1.12 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.444 -179.548 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.104 -0.95 . . . . 0.0 111.433 -179.95 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.469 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.614 0.245 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.483 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 3.1 t80 -49.44 -44.65 45.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.537 178.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -63.48 -56.71 24.31 Favored Pre-proline 0 N--CA 1.465 0.297 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.307 -179.584 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 70.5 Cg_exo -37.39 -25.24 0.06 OUTLIER 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 122.863 2.376 . . . . 0.0 112.759 179.244 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 27.1 mt -72.33 -54.26 9.99 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.742 179.215 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.573 HD23 HD11 ' A' ' 46' ' ' ILE . 12.9 mt -67.96 -26.06 65.75 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.134 179.044 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 11.6 mm-40 -63.72 -41.04 98.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.497 -179.614 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.2 m -66.05 -15.45 63.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.578 -179.765 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.543 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 88.1 mt -67.63 -10.98 57.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.726 0.298 . . . . 0.0 111.056 -179.728 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.5 t -98.09 15.88 22.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.089 -179.868 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.702 HD21 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -86.69 149.63 24.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.96 0.41 . . . . 0.0 111.12 -179.903 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.74 -37.46 82.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.994 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.13 158.21 32.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.956 -179.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 1.5 p90 -106.25 -21.0 13.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.962 179.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -64.76 -51.57 61.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.799 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.0 mt -62.32 -40.41 87.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.439 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.702 ' HB2' HD21 ' A' ' 33' ' ' ASN . 31.1 ttm180 -63.12 -20.98 65.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.534 179.56 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.92 -64.53 3.86 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.549 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.56 -36.31 4.57 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.694 0.283 . . . . 0.0 111.498 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.23 -47.94 83.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.992 0.425 . . . . 0.0 110.338 179.438 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.04 -30.91 69.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.112 179.533 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -70.73 -34.01 71.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.519 -178.704 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.424 ' HA ' HD22 ' A' ' 48' ' ' ASN . 35.9 mt -98.32 -19.34 5.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.82 0.343 . . . . 0.0 111.502 -179.464 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.609 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -56.1 -35.63 42.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.136 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.21 -18.48 78.06 Favored Glycine 0 C--N 1.329 0.16 0 C-N-CA 120.566 -0.826 . . . . 0.0 113.592 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.424 HD22 ' HA ' ' A' ' 45' ' ' ILE . 17.6 m-80 -58.16 -34.22 70.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.007 0.403 . . . . 0.0 111.098 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.438 ' C ' ' H ' ' A' ' 51' ' ' ASP . 12.0 m-85 -94.07 118.67 31.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.964 0.411 . . . . 0.0 110.963 179.593 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -72.13 20.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.81 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.438 ' H ' ' C ' ' A' ' 49' ' ' PHE . 28.7 t0 -83.8 137.25 33.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.754 0.311 . . . . 0.0 110.552 179.907 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -10.32 32.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.788 -179.044 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.486 ' HG2' HD11 ' A' ' 28' ' ' LEU . 12.3 ttt180 -62.28 -32.36 73.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.775 0.321 . . . . 0.0 110.652 -179.852 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.609 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -104.8 20.15 19.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.58 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.0 p -73.64 -38.66 52.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.823 0.344 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.452 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 19.2 tt0 -60.29 -53.35 65.71 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.591 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.477 ' O ' HD13 ' A' ' 61' ' ' LEU . 69.7 Cg_exo -38.91 -53.16 2.01 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.494 2.129 . . . . 0.0 112.635 179.702 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.515 ' HB3' HD21 ' A' ' 77' ' ' LEU . 11.6 mt -55.58 -48.29 75.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.5 -179.503 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 35.8 mm -58.03 -54.61 29.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.657 -179.46 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -69.81 -11.96 61.26 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.534 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.64 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.4 OUTLIER -87.46 -47.16 8.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.843 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.655 HD13 HD22 ' A' ' 92' ' ' LEU . 5.6 mt -56.24 -16.91 6.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.12 0.486 . . . . 0.0 110.846 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.06 -12.81 14.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.319 179.951 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.424 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.6 t0 -61.13 -35.52 77.28 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.18 0.514 . . . . 0.0 110.911 -179.958 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.65 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 42.9 m-20 52.59 29.95 7.93 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.747 179.792 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.469 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 43.9 t -84.36 -3.62 58.4 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.82 0.343 . . . . 0.0 111.028 179.892 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.88 -90.64 1.46 Allowed Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.434 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.79 -45.68 89.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.162 0.506 . . . . 0.0 109.801 179.435 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.64 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.3 t -69.19 -42.52 81.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.379 -179.873 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.65 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 0.9 OUTLIER -66.83 -62.84 1.24 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.023 -179.816 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.444 ' HA ' HH21 ' A' ' 70' ' ' ARG . 95.2 p -54.67 -24.94 23.97 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.005 179.715 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.58 -35.19 79.47 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.601 -179.915 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.467 ' O ' HD23 ' A' ' 77' ' ' LEU . . . -73.66 -38.61 64.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.556 0.217 . . . . 0.0 111.073 179.79 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.538 ' HB2' HH22 ' A' ' 70' ' ' ARG . . . -42.49 -42.06 3.17 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.027 -179.04 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -84.14 -31.23 25.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.285 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.665 ' HA ' HE21 ' A' ' 79' ' ' GLN . 67.7 m -63.06 -46.3 88.14 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.743 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.848 HD12 HG13 ' A' ' 85' ' ' VAL . 3.8 mm? -55.34 -60.93 2.72 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.73 0.3 . . . . 0.0 111.534 -178.909 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -61.25 -27.04 68.17 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.758 0.313 . . . . 0.0 111.459 179.807 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.665 HE21 ' HA ' ' A' ' 76' ' ' SER . 5.0 mt-30 -70.55 -24.57 62.82 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.174 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.428 ' HB ' ' CG2' ' A' ' 85' ' ' VAL . 85.0 mt -74.86 -60.99 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.141 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 179.55 -135.68 2.58 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 119.911 -1.137 . . . . 0.0 113.711 -179.49 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.618 ' H ' HH11 ' A' ' 84' ' ' ARG . . . -127.51 -78.89 0.27 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 121.151 -0.547 . . . . 0.0 112.508 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -58.67 -21.27 53.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.82 0.343 . . . . 0.0 111.766 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.618 HH11 ' H ' ' A' ' 82' ' ' GLY . 4.3 mpt_? -75.97 -62.88 1.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.243 0.544 . . . . 0.0 110.28 -178.715 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.848 HG13 HD12 ' A' ' 77' ' ' LEU . 39.4 t -70.72 -20.43 22.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.988 179.653 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 23.3 ttm180 -46.47 -26.71 0.91 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.746 -179.939 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.5 -36.3 22.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.778 179.794 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.91 -44.26 77.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.36 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.433 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 4.3 ppp? -64.3 -28.69 69.89 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.912 0.387 . . . . 0.0 110.049 179.88 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.418 ' N ' ' SD ' ' A' ' 89' ' ' MET . 22.5 mt-10 -70.42 -37.6 74.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.636 179.015 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.471 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 7.3 tmtm? -66.68 -33.83 76.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.393 179.358 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.655 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -85.84 -27.37 25.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.931 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.28 -30.37 69.41 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.456 179.064 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -80.18 -25.07 39.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.358 179.934 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 61.8 p -110.96 20.89 17.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.14 179.067 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.564 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -51.34 119.19 7.74 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.701 -178.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.1 m -152.67 130.27 11.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.545 -0.328 . . . . 0.0 110.503 179.189 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.46 -144.61 49.34 Favored Glycine 0 CA--C 1.518 0.275 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.481 -179.839 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -68.71 -29.33 67.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.81 0.338 . . . . 0.0 110.839 179.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.634 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.13 -41.73 49.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.519 -179.911 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.564 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 74.7 ttt180 -67.79 -54.49 18.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.524 -179.549 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -45.79 -28.51 1.08 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.281 -179.771 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.524 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 53.6 t -61.8 -60.19 3.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.057 179.242 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.593 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -53.54 -62.02 1.93 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.274 0.559 . . . . 0.0 111.776 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 46.3 t -54.41 -59.22 2.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.843 -178.643 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -56.84 -32.26 65.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.717 0.294 . . . . 0.0 111.612 -179.17 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.424 ' OH ' ' HA2' ' A' ' 82' ' ' GLY . 3.9 t80 -59.34 -27.88 66.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.047 0.451 . . . . 0.0 110.453 -179.678 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 41.8 mt -56.48 -22.25 31.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.398 179.884 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -56.04 -17.83 7.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.475 -179.887 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.1 p -93.7 -64.63 1.06 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.975 179.723 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.465 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 80.0 m80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.323 -0.846 . . . . 0.0 110.718 179.903 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.469 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.457 -0.102 0 CA-C-O 120.753 0.311 . . . . 0.0 111.653 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.437 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -58.0 -51.77 68.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 179.698 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.428 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.39 -54.02 47.71 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.725 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 89.5 Cg_exo -40.1 -35.94 1.34 Allowed 'Trans proline' 0 C--N 1.362 1.272 0 C-N-CA 122.177 1.918 . . . . 0.0 111.433 -179.955 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 27.1 mt -66.86 -53.91 27.65 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.985 178.501 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 31' ' ' LEU . 35.5 tp -61.65 -19.95 62.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.823 179.34 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -75.73 -43.25 47.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.21 -179.614 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.7 m -65.98 -14.37 61.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.363 -179.689 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.528 HD11 HG13 ' A' ' 46' ' ' ILE . 65.9 mt -70.33 -10.43 58.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.271 -179.918 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.6 p -101.79 10.32 40.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.701 179.795 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -81.65 145.76 30.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.76 -18.13 64.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.893 -179.957 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -77.71 142.15 38.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.921 -179.947 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 12.3 p90 -96.59 -22.2 17.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.148 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -72.2 -37.72 69.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.018 0.437 . . . . 0.0 110.693 -179.981 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.546 HD12 ' N ' ' A' ' 38' ' ' ILE . 1.8 mp -81.66 -36.13 14.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.736 -179.766 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.523 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 20.3 ttm180 -65.19 -25.51 67.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.489 -179.955 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.19 -64.59 3.05 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.509 -179.995 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.65 -39.48 24.38 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.661 0.267 . . . . 0.0 110.911 179.76 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 46' ' ' ILE . . . -57.25 -55.39 35.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.236 179.298 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.44 -33.93 71.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.255 179.209 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -64.97 -30.17 71.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.181 -179.814 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.434 ' O ' ' HB2' ' A' ' 48' ' ' ASN . 66.4 mt -98.73 -18.91 6.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.312 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.528 HG13 HD11 ' A' ' 31' ' ' LEU . 4.5 mm -50.41 -61.19 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.315 -179.234 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.677 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -68.56 -3.42 33.3 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.85 -0.691 . . . . 0.0 113.992 -178.395 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.586 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER -70.74 0.22 7.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 117.242 0.521 . . . . 0.0 111.078 -179.964 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -106.07 -23.01 12.73 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -179.747 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.614 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.6 OUTLIER 62.32 20.48 11.83 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.899 0.38 . . . . 0.0 110.946 -179.683 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -96.82 171.9 8.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.149 -179.874 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.427 ' O ' HG12 ' A' ' 55' ' ' VAL . 27.4 tt0 -66.41 -34.12 77.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.161 179.738 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -66.73 -13.23 61.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.963 0.411 . . . . 0.0 111.09 -179.719 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.458 ' HA ' HG23 ' A' ' 46' ' ' ILE . . . -101.68 6.38 41.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.928 -179.304 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 52' ' ' GLU . 1.3 p -92.24 -39.11 11.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.242 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.571 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 35.7 tt0 -60.26 -51.9 76.98 Favored Pre-proline 0 CA--C 1.53 0.211 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -178.99 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.571 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 88.1 Cg_exo -47.07 -49.21 13.07 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 121.881 1.721 . . . . 0.0 111.615 179.507 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.442 HD13 ' HG ' ' A' ' 77' ' ' LEU . 10.3 mt -56.77 -37.37 70.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.376 -179.697 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 55' ' ' VAL . 46.6 mm -61.89 -59.33 4.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.901 0.382 . . . . 0.0 111.985 -179.396 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.3 mmmt -70.02 -9.72 56.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.32 -178.873 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.679 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -87.46 -44.34 11.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -178.327 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.713 HD13 HD22 ' A' ' 92' ' ' LEU . 7.6 mt -59.19 -11.32 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.095 0.474 . . . . 0.0 110.641 -179.119 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -116.03 -14.84 11.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.153 -179.926 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -61.23 -22.95 65.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.248 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.57 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 4.0 p30 41.51 32.28 0.22 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.411 -0.813 . . . . 0.0 112.153 179.786 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.471 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 22.2 t -86.18 -8.73 57.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.195 -179.998 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.89 -86.03 1.09 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.248 -179.765 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.45 -42.95 99.56 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.103 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.679 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.2 t -68.69 -49.29 65.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.338 -179.766 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.57 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 51.5 ttp180 -62.7 -41.48 99.16 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.233 -179.758 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 80.5 p -64.26 -31.51 72.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.995 -179.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.21 -28.56 69.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.515 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.576 ' HB2' ' CB ' ' A' ' 61' ' ' LEU . . . -74.3 -58.55 3.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.655 0.264 . . . . 0.0 111.588 -179.844 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.509 ' HA ' HD12 ' A' ' 77' ' ' LEU . . . -60.1 -23.93 64.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.833 -179.204 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.6 ttt-85 -81.39 -47.86 12.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.722 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.677 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 8.7 m -67.22 -30.13 69.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.754 -179.494 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 74' ' ' ALA . 18.3 mt -60.76 -59.81 4.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.833 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -54.45 -36.3 63.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.234 179.392 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.586 HE21 ' HA ' ' A' ' 76' ' ' SER . 47.6 mt-30 -58.93 -37.36 76.51 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.918 0.39 . . . . 0.0 110.913 179.718 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.614 HG12 ' HG3' ' A' ' 50' ' ' GLN . 98.3 mt -71.97 -60.32 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.924 179.856 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 67.96 123.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.632 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.589 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 142.93 175.51 16.11 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.68 179.873 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -65.85 -26.15 67.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.761 0.315 . . . . 0.0 111.11 -179.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.589 HH11 ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -61.84 -54.31 43.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.665 -179.405 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.581 HG11 ' HB ' ' A' ' 80' ' ' ILE . 3.4 m -70.71 -23.8 24.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.84 0.352 . . . . 0.0 111.306 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.506 ' HA ' ' HG2' ' A' ' 89' ' ' MET . 68.5 ttt180 -58.64 -40.87 84.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.968 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.78 -33.45 70.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.738 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.22 -34.23 77.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.412 179.526 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.527 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 17.6 mmm -69.27 -55.44 10.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.042 -0.527 . . . . 0.0 109.981 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -54.03 -33.53 57.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.4 179.377 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -79.24 -22.84 44.22 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.683 179.242 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.713 HD22 HD13 ' A' ' 62' ' ' LEU . 1.8 tp -87.16 -30.67 20.87 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.707 179.858 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.77 -32.17 69.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.527 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.473 ' HG3' HG23 ' A' ' 95' ' ' THR . 12.9 pt-20 -80.39 -20.97 42.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.09 0.472 . . . . 0.0 110.15 179.853 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.473 HG23 ' HG3' ' A' ' 94' ' ' GLU . 45.1 p -119.23 28.8 8.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.677 179.015 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -52.66 120.98 13.16 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.222 -0.899 . . . . 0.0 113.75 -178.862 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.3 t -140.63 130.68 24.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.727 0.299 . . . . 0.0 110.334 178.895 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.46 -134.71 22.9 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.54 -0.838 . . . . 0.0 111.994 -179.463 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -93.85 -12.29 29.28 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.813 0.34 . . . . 0.0 110.541 179.698 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.653 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.8 -41.17 66.98 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.738 179.454 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -60.48 -56.64 18.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.051 179.86 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -48.56 -23.13 0.89 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.66 179.774 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.571 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 41.8 t -78.19 -55.83 9.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.646 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.65 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -52.93 -41.31 64.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.167 0.508 . . . . 0.0 112.206 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.43 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 85.2 t -64.89 -60.03 3.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.74 -178.318 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -65.54 -47.86 74.44 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.612 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.527 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 67.6 t80 -60.13 -22.63 63.08 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.666 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 4.6 mt -59.48 -20.83 58.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.602 -179.718 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -73.1 -9.7 59.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.338 -179.785 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 69.3 p -127.99 23.67 6.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.204 -179.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 26.4 m80 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.998 179.724 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.478 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.232 0.166 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.644 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 14.0 t80 -63.43 -44.84 93.43 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.468 ' HG3' ' NH1' ' A' ' 53' ' ' ARG . 3.2 mt-10 -53.39 -54.18 48.12 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.158 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 98.9 Cg_exo -43.11 -18.18 0.11 Allowed 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.719 2.279 . . . . 0.0 113.09 -179.998 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.577 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.8 mt -80.06 -58.15 3.29 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.323 179.724 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.6 -16.24 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.854 179.291 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -69.16 -30.96 69.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.621 178.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.4 t -66.45 -16.76 64.36 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.147 179.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.8 mt -62.42 -6.78 3.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.131 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.3 m -120.26 23.42 10.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.455 -179.566 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.425 HD21 ' N ' ' A' ' 39' ' ' ARG . 52.0 p-10 -90.15 150.52 21.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.33 -179.749 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -65.88 -35.17 79.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.031 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -75.96 156.48 34.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.206 -179.624 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -106.49 -33.94 7.54 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.098 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.498 ' HG3' HG13 ' A' ' 38' ' ' ILE . 33.2 ptt180 -59.79 -40.18 87.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.045 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.498 HG13 ' HG3' ' A' ' 37' ' ' ARG . 60.0 mt -77.69 -37.63 24.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.8 179.865 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.503 HH12 HD11 ' A' ' 61' ' ' LEU . 2.1 tmt_? -58.44 -22.96 56.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.379 179.416 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -78.88 -50.17 6.07 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.336 179.775 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.38 -34.25 23.5 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.836 0.35 . . . . 0.0 110.81 179.695 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.496 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -60.99 -55.14 36.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.202 179.291 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.4 ' O ' HG22 ' A' ' 46' ' ' ILE . . . -64.19 -25.97 68.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.953 179.459 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.5 m95 -70.63 -37.43 73.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.234 -178.938 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.542 ' HA ' HD22 ' A' ' 48' ' ' ASN . 52.7 mt -99.17 -19.53 5.87 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-O 120.969 0.414 . . . . 0.0 111.755 -178.66 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.624 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.0 tt -56.82 -36.02 48.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.489 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.521 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -77.97 -22.15 69.45 Favored Glycine 0 CA--C 1.518 0.242 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.369 -178.996 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.542 HD22 ' HA ' ' A' ' 45' ' ' ILE . 36.2 m-80 -70.75 2.14 4.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.352 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.444 ' HB3' ' OD2' ' A' ' 51' ' ' ASP . 36.8 m-85 -107.97 -25.42 11.18 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.788 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.786 HE21 ' HA ' ' A' ' 80' ' ' ILE . 25.9 mp0 63.76 39.64 8.33 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.12 0.486 . . . . 0.0 110.942 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.444 ' OD2' ' HB3' ' A' ' 49' ' ' PHE . 2.8 m-20 -100.8 169.51 8.95 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.532 -179.499 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.555 ' O ' HG22 ' A' ' 55' ' ' VAL . 8.7 pt-20 -66.48 -40.39 89.3 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.423 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.468 ' NH1' ' HG3' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -69.34 -8.7 48.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.658 0.266 . . . . 0.0 110.741 179.806 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.644 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -87.84 -35.99 17.47 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.584 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 52' ' ' GLU . 35.1 m -64.5 -39.57 86.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -178.003 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.653 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 3.6 tp10 -59.44 -54.2 58.37 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -178.641 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.653 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 80.1 Cg_exo -46.34 -52.11 7.76 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.297 1.998 . . . . 0.0 112.476 179.62 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.511 HD22 ' HA ' ' A' ' 73' ' ' ALA . 12.3 mt -53.65 -29.03 36.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.915 -179.14 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.0 mm -63.43 -60.73 2.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.43 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -70.1 -10.58 59.2 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -178.969 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.745 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.6 OUTLIER -83.02 -49.59 9.4 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.481 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.717 HD13 HD22 ' A' ' 92' ' ' LEU . 12.7 mt -56.39 -9.92 0.81 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.494 -179.311 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -123.78 -8.53 7.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.034 179.593 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.441 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 3.3 t70 -61.11 -38.83 87.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.074 0.464 . . . . 0.0 111.275 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.521 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 49.7 m-20 64.14 24.7 13.52 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.257 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.502 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.0 OUTLIER -83.91 7.64 17.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.291 -179.974 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.6 -78.32 0.73 Allowed Glycine 0 C--N 1.33 0.196 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.492 179.946 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -51.07 66.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.286 0.565 . . . . 0.0 109.969 179.422 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.745 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.8 t -62.63 -43.76 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.379 -179.8 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.521 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 37.8 ttp180 -66.77 -60.12 2.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.238 -179.686 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.0 m -51.51 -28.02 12.34 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.174 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -60.98 -46.01 95.44 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.184 179.702 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.511 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -66.96 -35.89 80.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.764 0.316 . . . . 0.0 111.085 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.17 -46.98 72.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.453 -179.691 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -78.88 -36.3 42.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.448 -179.688 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.521 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 58.8 m -59.37 -41.98 90.55 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.409 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.704 HD11 HD11 ' A' ' 62' ' ' LEU . 11.5 mt -61.1 -60.82 3.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.768 0.318 . . . . 0.0 110.718 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.451 ' HA ' ' CD1' ' A' ' 107' ' ' TYR . 34.0 mt-10 -53.77 -33.24 55.22 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.557 178.726 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -63.2 -42.48 99.33 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.853 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.786 ' HA ' HE21 ' A' ' 50' ' ' GLN . 91.7 mt -64.32 -60.39 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.21 179.117 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.59 133.32 0.05 OUTLIER Glycine 0 CA--C 1.518 0.251 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.881 179.782 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 133.39 164.36 10.76 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.586 179.822 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.4 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 12.7 pt-20 -65.19 -22.43 66.9 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.782 0.325 . . . . 0.0 110.738 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.638 ' HD3' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -60.57 -53.42 57.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 -179.998 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.638 ' N ' ' HD3' ' A' ' 84' ' ' ARG . 2.3 t -70.81 -26.14 27.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.053 0.454 . . . . 0.0 110.245 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.48 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 74.2 ttt180 -52.44 -31.9 36.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.756 -179.84 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.11 92.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.393 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.09 -35.94 78.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.219 179.34 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.668 ' HE1' HG12 ' A' ' 103' ' ' VAL . 8.2 mmm -67.8 -43.08 80.51 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.568 179.05 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 14.4 mm-40 -57.39 -36.4 71.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.724 178.494 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -75.89 -28.74 58.23 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.29 179.771 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.717 HD22 HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -87.16 -23.24 24.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.935 0.398 . . . . 0.0 110.428 179.817 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.15 -29.88 70.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.382 -179.843 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.516 ' HG3' HG23 ' A' ' 95' ' ' THR . 11.3 pt-20 -80.22 -23.23 41.04 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.975 0.417 . . . . 0.0 110.291 179.741 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.516 HG23 ' HG3' ' A' ' 94' ' ' GLU . 73.9 p -111.87 19.63 17.75 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.794 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.57 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -52.18 119.67 9.55 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 114.952 -1.022 . . . . 0.0 113.306 -179.201 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.3 t -144.1 130.35 19.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.813 0.339 . . . . 0.0 111.007 179.205 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.63 -131.01 50.74 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.902 179.936 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -77.36 -27.76 52.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.722 0.296 . . . . 0.0 111.278 -179.792 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.632 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.93 -31.42 50.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.68 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.57 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 47.8 ttt180 -75.31 -52.46 10.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.373 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -48.22 -22.0 0.59 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.268 0.556 . . . . 0.0 110.454 179.651 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.668 HG12 ' HE1' ' A' ' 89' ' ' MET . 49.1 t -69.05 -60.17 2.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.524 179.738 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.663 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.23 -46.97 84.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.179 0.514 . . . . 0.0 112.227 -179.596 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 59.5 t -64.88 -63.15 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -178.069 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -55.42 -37.3 67.48 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.199 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.585 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 22.9 t80 -61.5 -23.76 66.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.975 0.417 . . . . 0.0 111.421 -178.705 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 74.5 mt -58.1 -25.47 61.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.661 -179.478 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -85.38 0.45 52.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.522 -179.6 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 47.3 p -145.54 29.27 1.14 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -179.585 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.153 -0.927 . . . . 0.0 111.043 179.927 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.637 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.23 0.07 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.9 t80 -59.14 -56.21 25.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.698 -179.693 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.439 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.41 -51.26 69.08 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-O 119.216 -0.421 . . . . 0.0 111.724 179.979 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.637 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 59.8 Cg_exo -39.23 -29.65 0.22 Allowed 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 122.285 1.99 . . . . 0.0 111.254 179.174 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.9 mt -73.85 -55.18 6.52 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.726 -1.124 . . . . 0.0 109.339 177.882 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.52 HD22 HD12 ' A' ' 31' ' ' LEU . 3.0 tm? -53.33 -46.52 69.5 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.844 178.538 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -62.72 -41.87 99.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.738 179.931 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.558 ' HA ' ' HB2' ' A' ' 33' ' ' ASN . 47.4 t -66.37 -12.27 55.91 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.061 -179.278 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.52 HD12 HD22 ' A' ' 28' ' ' LEU . 49.0 mt -57.44 -24.3 54.78 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.915 0.388 . . . . 0.0 110.688 -179.774 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 71.3 p -125.8 21.81 7.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.628 179.723 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.558 ' HB2' ' HA ' ' A' ' 30' ' ' SER . 26.3 t-20 -57.36 141.22 47.86 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.074 -179.747 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.25 -43.51 96.07 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.731 -179.948 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -77.95 137.64 38.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.593 179.526 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 21.3 m95 -76.86 -29.79 56.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.146 -179.661 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -62.97 -45.29 93.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.875 179.902 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.6 mm -67.37 -36.06 75.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.766 179.771 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.609 HH12 HD21 ' A' ' 61' ' ' LEU . 1.3 tpm_? -64.9 -34.52 78.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.636 179.738 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.17 -64.46 2.99 Favored Glycine 0 C--N 1.33 0.204 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.751 -179.873 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.32 -33.91 9.68 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.732 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.576 ' HB3' HH21 ' A' ' 39' ' ' ARG . . . -63.64 -56.35 16.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.78 0.324 . . . . 0.0 110.782 179.967 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.27 -26.05 68.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.077 179.539 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.9 m95 -70.55 -39.72 73.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.526 -178.762 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.8 mt -98.88 -19.08 6.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.842 0.353 . . . . 0.0 111.868 -178.515 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.636 HD13 ' HG2' ' A' ' 57' ' ' PRO . 5.4 tt -53.9 -36.44 30.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.044 -178.996 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.27 -17.58 74.27 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.179 -179.551 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.559 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.9 OUTLIER -70.33 -7.26 41.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.703 0.251 . . . . 0.0 111.58 -179.486 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -94.15 -24.92 17.34 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.598 0.237 . . . . 0.0 111.476 -179.905 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.654 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.7 mp0 60.74 30.28 19.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.382 179.485 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.46 ' O ' HG23 ' A' ' 55' ' ' VAL . 11.2 t70 -102.67 162.27 13.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.733 179.844 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -61.35 -36.23 79.63 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.011 -179.829 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.412 ' HG3' HD23 ' A' ' 28' ' ' LEU . 35.0 ttm180 -67.33 -9.61 42.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.026 0.441 . . . . 0.0 110.457 179.634 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.92 -7.99 21.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.558 -179.795 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.46 HG23 ' O ' ' A' ' 51' ' ' ASP . 21.4 t -90.22 -35.2 7.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.005 -179.769 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.525 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 20.6 tt0 -60.16 -48.44 94.31 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.341 -179.926 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.636 ' HG2' HD13 ' A' ' 46' ' ' ILE . 83.7 Cg_exo -46.18 -48.44 13.04 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 122.341 2.027 . . . . 0.0 112.094 179.365 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.451 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 1.7 mt -56.04 -33.06 64.62 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.8 -179.468 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 39.8 mm -57.16 -60.8 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.066 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -38.29 75.16 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.974 0.416 . . . . 0.0 111.826 -179.488 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.708 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.6 mp -57.08 -49.37 76.07 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -178.389 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.565 ' HB3' HD22 ' A' ' 92' ' ' LEU . 34.5 mt -60.44 -9.58 3.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.272 0.558 . . . . 0.0 110.008 -179.672 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -117.58 -12.0 10.39 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.843 179.511 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.522 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 6.5 t70 -61.05 -48.37 82.06 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.233 0.54 . . . . 0.0 111.152 -179.499 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.477 ' HB2' ' NH2' ' A' ' 70' ' ' ARG . 20.3 t70 68.98 21.39 7.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.806 179.447 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.48 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 36.2 m -86.22 12.14 10.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.265 -179.785 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.3 -100.78 1.42 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.614 179.712 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -46.27 -36.61 6.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.155 0.502 . . . . 0.0 110.512 179.762 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.708 HG12 ' HG ' ' A' ' 61' ' ' LEU . 16.4 t -73.57 -47.23 45.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.989 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.477 ' NH2' ' HB2' ' A' ' 65' ' ' ASP . 14.0 ttm180 -71.75 -61.76 1.66 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.651 0.263 . . . . 0.0 111.542 -179.48 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 87.6 p -50.56 -31.16 14.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.341 -179.706 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -62.66 -39.42 97.9 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.734 179.919 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.451 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -73.49 -30.03 62.89 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.599 0.238 . . . . 0.0 111.363 -179.983 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.8 -46.22 74.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.643 -179.591 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.1 ptp180 -79.28 -17.09 55.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.384 -179.716 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.0 t -63.82 -44.34 93.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.285 179.778 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.449 HD12 HD13 ' A' ' 58' ' ' LEU . 6.4 mp -58.95 -60.26 4.15 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.77 0.319 . . . . 0.0 111.138 179.997 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.402 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 3.7 tm-20 -50.92 -39.17 53.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.151 179.651 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -55.98 -38.37 70.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.339 -179.876 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.654 HG12 ' HG3' ' A' ' 50' ' ' GLN . 61.2 mt -86.95 -60.63 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.425 -179.767 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.82 93.81 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.512 -179.858 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.484 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 179.48 -174.16 45.96 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.779 -179.888 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -67.81 -31.93 72.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.891 0.376 . . . . 0.0 111.202 -179.7 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.549 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -60.44 -56.22 24.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.088 -179.814 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.549 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.6 OUTLIER -70.83 -20.69 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.839 0.352 . . . . 0.0 110.889 179.488 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.474 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 2.2 tmt_? -55.81 -31.98 63.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.801 179.404 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.421 ' O ' ' HG3' ' A' ' 90' ' ' GLU . . . -76.99 -23.94 52.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.865 179.801 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.24 -44.68 64.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.749 179.676 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.529 ' SD ' ' N ' ' A' ' 90' ' ' GLU . 2.3 ppp? -71.93 -30.58 65.48 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.276 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.529 ' N ' ' SD ' ' A' ' 89' ' ' MET . 1.0 OUTLIER -75.91 -29.19 58.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.936 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -72.05 -30.62 65.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.907 178.851 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.764 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.4 OUTLIER -87.33 -31.8 19.98 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.285 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.49 -24.98 61.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.408 178.807 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.21 -26.58 39.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.12 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 68.0 p -121.54 27.6 8.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.43 179.024 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -54.09 125.12 32.51 Favored Glycine 0 N--CA 1.448 -0.539 0 CA-C-N 115.086 -0.961 . . . . 0.0 113.683 -178.822 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.1 t -150.25 130.34 13.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.897 0.379 . . . . 0.0 111.033 179.129 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.22 -146.92 42.71 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.895 179.895 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.13 -28.71 62.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.672 0.272 . . . . 0.0 111.404 -179.805 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.679 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -55.25 -53.84 50.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.704 -179.79 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 39.4 ttp180 -55.24 -61.04 2.59 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.249 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 23.5 ttpp -45.67 -30.59 1.6 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.484 -179.174 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.535 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 4.8 t -65.06 -59.08 4.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.715 -179.82 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.764 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -51.39 -60.4 3.18 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.293 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 92.2 t -57.96 -61.24 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.447 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.401 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 12.0 m120 -55.49 -29.73 59.34 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.804 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.402 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 5.2 t80 -60.28 -33.07 71.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.135 0.493 . . . . 0.0 110.499 -179.899 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.433 HD21 ' SD ' ' A' ' 89' ' ' MET . 74.5 mt -55.24 -13.43 1.31 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.865 -179.419 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.504 ' HG3' HG23 ' A' ' 110' ' ' THR . 9.0 pt-20 -78.42 5.22 11.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.553 -179.998 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.504 HG23 ' HG3' ' A' ' 109' ' ' GLU . 70.0 p -144.98 7.06 1.19 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.436 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.824 -179.993 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.421 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 CA--C 1.523 -0.079 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.09 -52.95 62.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 110.316 179.449 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -63.37 -54.98 39.56 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.19 179.703 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 43.7 Cg_exo -51.74 -19.49 7.94 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.754 1.636 . . . . 0.0 110.758 179.733 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.662 HD21 ' HA ' ' A' ' 46' ' ' ILE . 1.4 tp -87.05 -36.06 18.39 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.416 179.809 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.64 HD12 HD12 ' A' ' 31' ' ' LEU . 21.1 tp -81.94 -22.48 36.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.338 -179.942 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.452 ' HG2' ' HA ' ' A' ' 26' ' ' PRO . 0.7 OUTLIER -74.91 -32.25 61.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.864 0.364 . . . . 0.0 110.998 -179.407 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 93.7 p -66.44 -20.05 65.95 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.41 -179.872 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.64 HD12 HD12 ' A' ' 28' ' ' LEU . 81.4 mt -66.19 -7.83 20.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.263 -179.824 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 98.2 p -106.91 21.82 16.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.826 179.769 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -84.7 142.99 29.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.08 -179.918 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -67.19 -17.53 64.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.597 179.746 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -86.36 156.63 20.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.659 179.835 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.9 p-90 -100.66 -34.29 9.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.427 -179.53 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -64.82 -44.74 88.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.774 0.321 . . . . 0.0 111.098 -179.901 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.4 mt -63.8 -42.92 97.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.717 -179.896 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -63.99 -21.63 66.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.553 179.765 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.12 -61.09 7.01 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.508 179.856 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.75 -34.77 28.49 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.737 0.303 . . . . 0.0 111.211 179.832 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.5 -56.72 18.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.709 179.729 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.37 -32.69 72.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.56 179.426 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.8 m95 -70.7 -29.33 65.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.466 -179.313 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.1 mt -99.02 -25.04 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-O 120.931 0.395 . . . . 0.0 111.574 -179.06 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.662 ' HA ' HD21 ' A' ' 27' ' ' LEU . 2.8 tt -60.55 -28.13 41.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.502 -178.792 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.569 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -66.23 -26.1 72.48 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.489 179.777 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.545 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER -53.14 -39.65 63.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.398 . . . . 0.0 110.159 179.615 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -87.54 119.58 27.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.275 179.203 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.417 ' HG2' HG23 ' A' ' 80' ' ' ILE . 51.8 mt-30 -81.79 24.99 0.57 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.674 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -83.94 163.09 20.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.096 -179.8 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.45 -25.97 66.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.183 -179.805 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.436 ' HD3' HD22 ' A' ' 28' ' ' LEU . 18.7 ttm180 -68.12 -12.81 61.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.759 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.57 -4.47 21.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 -179.374 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.5 t -83.76 -40.09 15.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.916 -179.091 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 2.1 tm-20 -60.21 -49.61 89.93 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 -179.643 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.496 ' HG2' HD13 ' A' ' 46' ' ' ILE . 92.8 Cg_exo -43.72 -52.3 5.45 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 122.244 1.963 . . . . 0.0 112.083 179.229 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 24.5 mt -49.82 -37.14 29.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.394 -0.821 . . . . 0.0 112.197 -179.81 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 44.7 mm -61.0 -62.09 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.07 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.423 ' HG3' HD13 ' A' ' 61' ' ' LEU . 5.3 pttt -72.71 -6.58 45.5 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.934 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.705 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -89.03 -46.45 8.85 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -178.322 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.801 HD13 HD22 ' A' ' 92' ' ' LEU . 10.0 mt -60.76 -10.01 4.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.14 0.495 . . . . 0.0 110.377 -179.277 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -115.46 -14.98 11.54 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.146 -179.655 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -61.13 -31.59 71.3 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.124 0.488 . . . . 0.0 111.284 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.495 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 55.6 m-20 51.58 28.08 4.4 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.039 179.912 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 33.0 t -86.33 7.13 26.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.683 0.278 . . . . 0.0 111.27 179.903 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.59 -96.02 1.73 Allowed Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.296 -179.89 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -50.33 -43.63 54.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.128 0.49 . . . . 0.0 110.15 179.524 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.705 HG12 ' HG ' ' A' ' 61' ' ' LEU . 11.8 t -73.62 -46.23 48.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.864 -179.806 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.495 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 4.3 tmm_? -66.09 -64.03 0.95 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.549 -179.091 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.9 m -54.39 -27.1 34.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.608 179.827 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.6 -46.46 88.57 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.64 -0.79 . . . . 0.0 111.936 179.57 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' ' 77' ' ' LEU . . . -59.19 -56.09 26.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.581 0.229 . . . . 0.0 111.14 179.774 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -51.79 -27.0 10.87 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.07 0.462 . . . . 0.0 110.883 -179.562 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 34.8 ttt85 -80.31 -40.04 27.54 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.916 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.569 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 0.0 OUTLIER -67.08 -35.24 79.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.2 -178.966 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.474 HD12 ' O ' ' A' ' 73' ' ' ALA . 3.5 mp -56.68 -59.06 5.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.654 0.264 . . . . 0.0 111.092 -179.663 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.442 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 44.7 mt-10 -49.0 -27.15 2.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.804 179.817 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.4 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 68.4 mt-30 -70.73 -43.61 68.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.779 0.323 . . . . 0.0 111.501 -179.86 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.417 HG23 ' HG2' ' A' ' 50' ' ' GLN . 46.7 mt -70.06 -61.28 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.8 -179.12 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 53.14 89.52 0.01 OUTLIER Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.498 -179.716 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.448 ' H ' ' CG1' ' A' ' 85' ' ' VAL . . . 178.33 -173.45 45.88 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.607 -179.623 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.436 ' O ' ' HB2' ' A' ' 86' ' ' ARG . 4.9 tm-20 -72.24 -25.8 61.77 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.781 0.324 . . . . 0.0 111.181 -179.691 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.551 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -70.0 -50.72 38.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.984 0.421 . . . . 0.0 110.499 179.839 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.551 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 11.5 p -70.66 -25.69 26.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.434 179.132 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.593 ' NH2' ' HA ' ' A' ' 108' ' ' LEU . 1.1 mmp_? -47.12 -40.08 14.74 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.152 179.635 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.11 -30.92 71.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.443 -179.389 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.36 -55.42 33.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.81 -179.796 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.492 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.3 -25.86 65.35 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.198 -179.389 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 42.5 mt-10 -73.02 -34.37 66.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.97 0.414 . . . . 0.0 109.995 179.133 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -78.92 -24.9 43.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.427 179.111 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.801 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -87.63 -30.19 20.64 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.203 179.323 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.27 -29.97 67.96 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.147 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.07 -26.57 39.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.15 0.5 . . . . 0.0 109.692 179.339 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.8 p -107.59 21.24 17.75 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.608 178.524 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.617 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -46.48 108.53 0.27 Allowed Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.124 -0.943 . . . . 0.0 112.751 -179.431 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.441 ' O ' ' HB3' ' A' ' 100' ' ' ALA . 33.1 p -139.75 129.36 24.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.732 0.301 . . . . 0.0 110.727 -179.882 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 55.38 -145.02 32.11 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.858 -179.879 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -58.92 -30.46 67.86 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.715 0.293 . . . . 0.0 111.161 179.975 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.631 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -52.19 -42.59 63.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.852 -179.615 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.617 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 43.2 ttt180 -66.5 -55.6 14.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.676 0.274 . . . . 0.0 111.623 -179.535 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.2 tptp -46.05 -25.13 0.52 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.593 179.915 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.519 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 21.3 t -71.83 -58.43 5.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.912 -179.868 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.541 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -51.35 -60.88 2.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.819 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.522 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 21.8 t -56.58 -47.9 81.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -178.04 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -71.01 -35.01 71.89 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -179.52 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.514 ' OH ' HG11 ' A' ' 85' ' ' VAL . 14.1 t80 -64.11 -46.96 81.91 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.292 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.593 ' HA ' ' NH2' ' A' ' 86' ' ' ARG . 3.0 pp -55.34 -10.85 0.66 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.187 -178.882 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -89.11 6.96 37.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.52 0.2 . . . . 0.0 111.467 179.735 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.5 p -129.81 -66.54 0.79 Allowed 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.792 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.521 ' HB3' HH22 ' A' ' 86' ' ' ARG . 21.4 p80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 117.949 -1.024 . . . . 0.0 111.331 -179.266 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.945 0.402 . . . . 0.0 110.795 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.638 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.4 t80 -63.53 -45.28 91.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.444 179.95 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.446 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 24.2 mt-10 -63.37 -55.63 33.97 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.018 -179.653 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 9.4 Cg_endo -54.93 -16.1 11.2 Favored 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 121.74 1.626 . . . . 0.0 110.704 179.344 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.44 ' HB3' ' O ' ' A' ' 24' ' ' PHE . 1.0 OUTLIER -85.62 -34.31 21.43 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.461 -1.245 . . . . 0.0 108.881 178.842 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.491 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -77.32 -39.26 48.4 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.988 178.869 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -64.52 -37.14 86.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.214 -179.308 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 89.4 p -66.33 -14.56 62.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.945 -179.172 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.45 HD12 HD13 ' A' ' 28' ' ' LEU . 96.5 mt -60.15 -29.15 68.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.747 0.308 . . . . 0.0 111.154 -179.893 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.9 m -92.46 20.88 5.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.667 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.764 HD21 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -75.3 150.56 38.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.851 179.995 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -67.05 -20.7 65.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.304 -179.807 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.423 ' HB2' ' OD1' ' A' ' 33' ' ' ASN . 7.5 m-20 -78.65 162.98 25.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.893 0.378 . . . . 0.0 111.052 -179.821 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -104.57 -44.43 4.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.829 -179.7 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.506 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 71.4 mtp85 -58.83 -58.36 8.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.663 -179.703 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.467 ' HB ' ' OD1' ' A' ' 33' ' ' ASN . 71.1 mt -50.05 -40.6 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.496 -179.582 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.764 ' HB2' HD21 ' A' ' 33' ' ' ASN . 43.1 ttp180 -64.41 -40.22 95.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.012 179.896 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -59.8 -58.86 12.0 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.285 179.952 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.66 -28.81 6.34 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.683 0.278 . . . . 0.0 111.173 179.675 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 39' ' ' ARG . . . -59.24 -56.37 23.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.721 179.702 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.61 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -64.24 -32.47 74.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.611 179.445 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.418 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 12.6 m95 -55.72 -32.02 62.98 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.959 179.926 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.483 ' HA ' HD22 ' A' ' 48' ' ' ASN . 50.9 mm -98.51 -24.52 4.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.61 179.507 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.61 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 5.6 mm -55.43 -44.59 76.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.654 -179.979 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.34 -22.75 59.15 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.796 -0.716 . . . . 0.0 113.214 -179.397 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.483 HD22 ' HA ' ' A' ' 45' ' ' ILE . 44.1 m-80 -68.42 -40.55 81.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.81 0.305 . . . . 0.0 111.445 -179.797 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -97.15 112.22 24.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.718 0.294 . . . . 0.0 110.452 -179.929 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.73 ' H ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -77.22 58.14 1.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.767 179.762 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -102.7 172.69 6.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.935 -179.526 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -66.25 -45.47 80.44 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.876 -179.307 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -6.92 13.26 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.244 -0.183 . . . . 0.0 111.118 179.893 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.638 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -95.65 8.92 42.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.011 0.434 . . . . 0.0 111.042 -178.752 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 45.4 t -92.01 -59.11 3.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.558 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.415 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 27.3 tt0 -60.29 -49.64 89.63 Favored Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.495 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.47 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 58.4 Cg_exo -38.23 -44.88 2.06 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.709 2.273 . . . . 0.0 113.391 -179.088 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.609 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 8.0 mt -62.55 -54.05 45.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.321 -179.369 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.416 ' HA ' HD12 ' A' ' 62' ' ' LEU . 83.1 mt -50.53 -53.95 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.048 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.426 ' H ' ' HG3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -70.16 -24.27 63.13 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -177.956 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.586 ' HG ' HG12 ' A' ' 69' ' ' VAL . 3.7 tp -90.13 -20.0 23.63 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -178.716 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.668 HD13 HD11 ' A' ' 92' ' ' LEU . 6.3 mt -69.5 -12.59 61.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.937 0.399 . . . . 0.0 110.635 -179.916 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -112.68 1.73 15.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.978 -179.893 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -61.15 -30.35 70.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.165 0.507 . . . . 0.0 110.642 179.759 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.544 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 26.3 m-20 48.63 27.6 1.54 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.135 -0.939 . . . . 0.0 112.279 179.628 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.49 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 38.6 t -86.32 -15.06 41.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.765 0.316 . . . . 0.0 110.677 179.808 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 118.0 -109.94 1.9 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.504 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.506 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -59.15 -25.42 63.87 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.659 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.586 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.4 t -71.18 -32.29 47.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.645 178.61 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.544 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 52.8 ttp180 -78.7 -44.39 23.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.698 179.422 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.457 ' HA ' ' HZ ' ' A' ' 99' ' ' PHE . 28.9 t -67.09 -41.73 85.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.452 -179.83 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -51.18 -45.83 51.6 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.417 -179.79 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.609 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -71.75 -31.79 67.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.649 0.262 . . . . 0.0 111.048 179.68 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.636 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -60.17 -54.22 48.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.755 -179.224 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -61.88 -27.5 68.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.328 -179.645 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.443 ' HB2' HD22 ' A' ' 58' ' ' LEU . 50.4 m -58.87 -33.98 71.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.127 -179.831 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.611 HD11 HD11 ' A' ' 62' ' ' LEU . 9.1 mp -61.25 -60.64 3.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.89 0.376 . . . . 0.0 110.441 179.455 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -55.84 -24.95 39.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.295 178.909 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.419 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 37.8 mt-30 -70.73 -50.91 31.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.741 179.767 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.544 ' HB ' HG21 ' A' ' 85' ' ' VAL . 74.3 mt -66.03 -60.79 2.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.057 -179.984 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.64 127.46 0.02 OUTLIER Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.621 179.913 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 145.06 178.04 20.33 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.848 179.775 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.53 -34.35 78.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.846 0.355 . . . . 0.0 110.714 -179.99 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.51 ' H ' ' CD ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.72 -47.82 81.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.942 -179.881 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.544 HG21 ' HB ' ' A' ' 80' ' ' ILE . 33.1 t -70.56 -26.33 28.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.419 . . . . 0.0 110.648 179.654 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -58.61 -23.13 58.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.671 -179.895 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.9 -27.97 26.26 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.193 0.52 . . . . 0.0 109.771 179.434 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.98 -40.03 83.2 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.213 179.049 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.723 ' HE1' HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.2 -36.96 74.95 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.656 179.181 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -57.86 -32.72 67.94 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.623 178.876 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.8 tmtm? -64.56 -52.65 56.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.736 179.57 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.668 HD11 HD13 ' A' ' 62' ' ' LEU . 54.4 mt -61.83 -37.59 85.01 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.717 0.294 . . . . 0.0 110.712 -179.915 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.414 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -54.58 -31.03 56.06 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.179 0.514 . . . . 0.0 110.282 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -86.66 -21.93 26.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.013 179.425 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.2 p -118.01 38.15 3.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.122 -179.869 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.417 ' HA2' ' HB2' ' A' ' 101' ' ' ARG . . . -39.4 109.36 0.11 Allowed Glycine 0 C--N 1.334 0.448 0 CA-C-N 116.092 -0.504 . . . . 0.0 113.198 -179.78 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.1 t -151.88 138.55 18.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.834 0.349 . . . . 0.0 111.459 -179.888 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 55.09 -139.24 41.35 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.81 179.673 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.457 ' HZ ' ' HA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -94.76 -13.97 25.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.843 0.354 . . . . 0.0 110.6 -179.903 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.426 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -56.37 -35.02 67.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.829 179.824 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.417 ' HB2' ' HA2' ' A' ' 96' ' ' GLY . 11.0 tpt180 -61.74 -60.27 3.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.335 179.486 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.518 ' HG3' ' ND2' ' A' ' 106' ' ' ASN . 32.2 ttpt -51.55 -32.62 28.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.022 179.277 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.426 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 22.7 t -64.57 -46.87 91.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.97 179.484 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.549 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -61.49 -51.92 66.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.977 -179.562 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 59.9 t -63.62 -60.9 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.273 -179.022 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.518 ' ND2' ' HG3' ' A' ' 102' ' ' LYS . 17.3 m-80 -57.26 -30.08 64.36 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.744 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.03 -29.44 67.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.165 0.507 . . . . 0.0 110.039 -179.892 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.723 HD11 ' HE1' ' A' ' 89' ' ' MET . 98.0 mt -55.61 -25.29 37.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.011 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -51.26 -34.97 35.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.9 p -95.99 -57.0 2.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.329 179.994 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.959 179.993 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.408 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.231 0.117 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.472 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.3 t80 -60.93 -48.01 83.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.24 -179.917 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.411 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.49 -55.26 36.61 Favored Pre-proline 0 C--N 1.33 -0.249 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.238 179.775 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.411 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 52.5 Cg_exo -49.73 -26.34 13.12 Favored 'Trans proline' 0 C--N 1.357 1.019 0 C-N-CA 121.726 1.617 . . . . 0.0 110.458 179.022 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.52 HD11 HD12 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -76.93 -42.51 39.08 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.554 179.186 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 31' ' ' LEU . 11.7 tp -76.16 -17.15 59.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.04 178.937 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -74.53 -32.16 62.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.744 -179.79 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.482 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 71.6 m -66.41 -22.48 66.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.235 -179.779 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.684 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 93.6 mt -67.01 -9.54 40.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.81 0.338 . . . . 0.0 110.851 179.942 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.4 t -112.42 19.57 17.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.8 179.853 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.482 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 77.0 m-20 -89.82 147.53 23.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.212 -179.974 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -66.23 -23.05 66.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.772 179.835 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -78.01 149.18 34.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.935 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.6 p90 -93.28 -38.45 11.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.861 180.0 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.433 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 72.9 mtt-85 -60.4 -54.08 49.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.314 179.693 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.3 mm -54.57 -40.88 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.589 -179.359 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.684 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 39.7 ttm180 -65.46 -27.34 68.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.381 -179.774 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.533 ' HA2' HG13 ' A' ' 69' ' ' VAL . . . -64.4 -63.0 4.61 Favored Glycine 0 N--CA 1.453 -0.183 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.546 -179.782 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.57 -22.69 0.3 Allowed 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 179.995 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.431 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.5 -57.31 13.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.727 0.298 . . . . 0.0 110.924 179.85 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.97 -24.89 66.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.922 0.392 . . . . 0.0 110.805 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -61.85 -39.2 91.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.394 -179.925 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 33.5 mm -100.93 -21.62 5.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-O 120.831 0.348 . . . . 0.0 111.8 -179.521 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.52 HD12 HD11 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -54.52 -38.01 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.265 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.3 -20.6 79.6 Favored Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 120.507 -0.854 . . . . 0.0 113.205 -178.979 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.8 -0.8 9.77 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.383 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.432 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 91.0 m-85 -103.68 -34.01 8.76 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.716 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 49' ' ' PHE . 16.8 mt-30 67.31 57.27 0.59 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.245 0.545 . . . . 0.0 110.976 179.9 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -128.26 164.72 21.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.041 -179.803 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -65.48 -32.48 74.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.149 0.5 . . . . 0.0 110.098 179.355 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -69.3 -9.65 54.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.806 179.81 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.494 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -104.68 2.16 30.18 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.997 -179.378 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.2 t -86.57 -47.72 16.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.444 -179.416 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.492 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 23.2 tt0 -60.35 -47.76 95.67 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.788 -179.838 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 98.7 Cg_exo -43.68 -42.7 11.56 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.589 2.193 . . . . 0.0 113.002 -179.622 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.618 HD13 HD12 ' A' ' 77' ' ' LEU . 11.3 mt -64.66 -39.79 94.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.057 -179.874 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.423 HD11 ' HB1' ' A' ' 88' ' ' ALA . 47.6 mm -54.57 -57.66 5.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.981 -179.564 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.2 tmmm? -70.07 -28.46 65.45 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -178.353 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.538 ' HB3' ' HB2' ' A' ' 73' ' ' ALA . 4.7 tp -89.62 -21.39 22.83 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -177.521 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.749 HD13 HD22 ' A' ' 92' ' ' LEU . 22.4 mt -67.19 -20.81 65.77 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.584 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -92.41 -11.38 35.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.676 178.764 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.412 ' OD2' ' HB ' ' A' ' 69' ' ' VAL . 11.9 t70 -52.27 145.76 10.38 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.883 -178.523 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -118.29 27.0 9.23 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.021 -179.836 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.537 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 27.0 t -86.44 -36.38 19.13 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.898 -179.903 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 126.76 -96.72 0.47 Allowed Glycine 0 N--CA 1.452 -0.263 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.921 -179.603 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.433 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -61.48 -26.97 68.25 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.104 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.537 ' HB ' ' HB3' ' A' ' 66' ' ' SER . 32.2 t -67.95 -36.48 75.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.106 178.999 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -74.04 -55.3 6.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.358 179.549 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 36.8 t -59.07 -25.76 64.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.929 179.833 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.59 -45.6 89.87 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.367 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.538 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . . . -70.04 -30.28 67.52 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.863 0.363 . . . . 0.0 110.674 179.664 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 77' ' ' LEU . . . -61.75 -53.04 61.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.897 -179.439 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -66.22 -22.53 66.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.682 -179.152 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.574 ' HA ' HE21 ' A' ' 79' ' ' GLN . 40.4 t -58.59 -32.84 69.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.488 -179.645 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.618 HD12 HD13 ' A' ' 58' ' ' LEU . 7.2 mp -55.38 -62.27 1.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.503 -179.82 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.461 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 42.2 mt-10 -55.42 -32.84 63.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.255 179.563 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.574 HE21 ' HA ' ' A' ' 76' ' ' SER . 22.7 mt-30 -70.7 -27.17 63.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.165 -179.961 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 76' ' ' SER . 96.7 mt -83.16 -59.02 3.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.769 -179.284 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.645 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . -179.56 -116.37 0.51 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.034 -1.079 . . . . 0.0 113.411 -179.516 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.454 ' O ' ' HB2' ' A' ' 86' ' ' ARG . . . -157.91 -71.02 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 121.208 -0.52 . . . . 0.0 112.022 -179.972 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.419 ' HG3' ' NH2' ' A' ' 86' ' ' ARG . 43.1 tt0 -72.24 -21.83 61.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.864 0.364 . . . . 0.0 111.244 -179.922 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.645 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.0 OUTLIER -75.58 -56.97 4.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.206 -178.912 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' ' SD ' ' A' ' 89' ' ' MET . 0.4 OUTLIER -68.3 -29.94 46.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.413 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 33.1 ttp180 -41.83 -35.05 0.74 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.921 -179.401 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.83 -49.37 75.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.872 0.368 . . . . 0.0 110.764 -179.877 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.423 ' HB1' HD11 ' A' ' 59' ' ' ILE . . . -69.44 -34.54 74.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.859 179.588 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.617 ' HG3' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -60.64 -48.45 81.71 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.18 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 46.7 mt-10 -56.13 -35.6 67.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.425 178.051 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -76.54 -25.86 54.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.979 179.753 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.813 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.9 OUTLIER -84.46 -24.98 29.26 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.774 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.71 -28.05 68.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.894 178.904 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -80.24 -25.66 39.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.258 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.8 p -109.42 17.18 21.72 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.433 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.534 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -54.49 116.82 6.89 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 114.7 -1.136 . . . . 0.0 113.311 -179.079 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.3 t -142.41 132.14 24.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.861 0.362 . . . . 0.0 110.958 179.258 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.26 -124.72 35.51 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.559 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.574 ' O ' HG23 ' A' ' 103' ' ' VAL . 68.5 t80 -79.91 -29.99 39.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.881 0.372 . . . . 0.0 110.37 179.583 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.587 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.79 -36.11 35.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.483 179.837 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.534 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 23.4 ttt180 -70.4 -61.11 1.9 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.655 -179.535 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -47.8 -22.27 0.52 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.238 -179.492 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 99' ' ' PHE . 39.2 t -63.53 -60.27 3.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.792 -179.916 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.813 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.99 -62.35 1.88 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.224 0.535 . . . . 0.0 112.431 -179.203 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.537 HG13 ' H ' ' A' ' 106' ' ' ASN . 3.1 p -52.68 -56.81 5.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.227 -0.897 . . . . 0.0 113.267 -178.294 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.537 ' H ' HG13 ' A' ' 105' ' ' VAL . 55.1 t30 -59.97 -35.38 74.87 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -178.813 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.582 ' HD2' ' HG2' ' A' ' 89' ' ' MET . 30.2 t80 -61.8 -25.48 67.52 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.98 0.419 . . . . 0.0 110.688 -179.323 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 99.3 mt -58.95 -13.18 5.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.592 179.694 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -64.98 -7.24 10.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.604 179.84 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 73.0 p -93.12 -49.82 5.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.648 179.64 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.884 179.486 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.531 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.182 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.474 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.9 t80 -57.99 -52.38 65.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.717 -179.028 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.46 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 2.8 mt-10 -62.63 -57.17 23.63 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.674 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 13.9 Cg_endo -57.41 -12.03 9.82 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 122.112 1.875 . . . . 0.0 111.892 -179.729 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.636 HD21 ' HA ' ' A' ' 46' ' ' ILE . 1.9 tp -84.89 -44.3 13.31 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.96 179.899 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.438 ' H ' ' HG ' ' A' ' 28' ' ' LEU . 3.1 pp -84.34 -16.34 43.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.693 178.733 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -71.76 -31.38 66.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.086 179.566 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 t -66.35 -19.09 65.71 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.122 179.986 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 57' ' ' PRO . 91.5 mt -57.14 -16.77 8.49 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.856 0.36 . . . . 0.0 111.03 -179.926 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 74.6 m -94.7 23.46 5.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.224 -179.94 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.553 HD21 ' HB2' ' A' ' 39' ' ' ARG . 2.2 p30 -85.37 147.48 26.49 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.819 0.342 . . . . 0.0 110.583 -179.728 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -66.95 -25.89 66.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.143 -178.885 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -82.72 163.54 21.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.35 . . . . 0.0 111.082 -179.798 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.7 p-90 -101.75 -35.68 8.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.141 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.512 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 67.9 ttt180 -62.78 -29.74 70.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.35 -179.78 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.1 mt -76.5 -48.98 25.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.785 0.326 . . . . 0.0 111.256 -179.793 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.553 ' HB2' HD21 ' A' ' 33' ' ' ASN . 31.5 ttm180 -55.69 -27.83 52.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.254 -179.715 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.689 ' HA2' HD21 ' A' ' 61' ' ' LEU . . . -67.68 -55.68 13.78 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.744 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.13 -29.67 14.18 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.774 0.321 . . . . 0.0 111.245 179.793 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.564 ' O ' HD11 ' A' ' 27' ' ' LEU . . . -57.73 -54.37 47.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.851 179.797 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.542 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -68.43 -29.3 67.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.008 179.943 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.419 ' CD1' ' HA3' ' A' ' 72' ' ' GLY . 6.6 m95 -59.94 -38.04 81.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.626 -179.899 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.1 mm -98.87 -19.49 5.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.837 0.351 . . . . 0.0 111.718 -179.776 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.672 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.2 OUTLIER -52.74 -44.03 46.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.009 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.97 -13.51 83.09 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.69 -0.767 . . . . 0.0 113.701 -178.748 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.537 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.9 OUTLIER -70.77 -3.5 19.11 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 -179.37 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -99.59 -30.4 12.15 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.27 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.467 ' HG3' HG13 ' A' ' 80' ' ' ILE . 1.1 tt0 71.0 51.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.135 0.493 . . . . 0.0 111.029 179.284 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -127.45 155.71 43.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.13 -179.97 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.576 ' O ' HG22 ' A' ' 55' ' ' VAL . 0.4 OUTLIER -63.51 -30.3 71.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.664 179.734 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -69.22 -10.11 56.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.96 179.738 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.672 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -94.54 11.96 29.08 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -179.032 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.576 HG22 ' O ' ' A' ' 52' ' ' GLU . 23.0 m -91.68 -42.15 13.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.359 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.592 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 6.5 tp10 -60.34 -50.31 86.42 Favored Pre-proline 0 C--N 1.327 -0.378 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.667 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.676 ' HB3' HD11 ' A' ' 31' ' ' LEU . 52.3 Cg_exo -53.67 -23.54 26.46 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.262 1.975 . . . . 0.0 112.88 -179.271 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.546 HD22 ' HA ' ' A' ' 73' ' ' ALA . 57.2 mt -84.99 -40.69 16.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.09 -179.58 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.607 ' HA ' HD12 ' A' ' 62' ' ' LEU . 49.9 mm -58.88 -43.33 88.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.837 -179.536 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -70.03 -26.65 64.14 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -178.821 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.689 HD21 ' HA2' ' A' ' 40' ' ' GLY . 5.2 tp -88.97 -29.07 19.81 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -178.21 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.639 HD13 HD22 ' A' ' 92' ' ' LEU . 15.5 mt -58.66 -19.16 36.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.975 0.417 . . . . 0.0 110.565 179.153 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -111.93 -0.93 15.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.162 -179.882 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.541 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 6.2 t70 -61.25 -36.95 81.38 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.408 0.623 . . . . 0.0 110.482 -179.849 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.459 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 10.8 m-20 56.7 25.67 10.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.522 179.296 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.456 ' HB2' ' OD1' ' A' ' 64' ' ' ASP . 0.3 OUTLIER -80.5 -27.75 37.66 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 121.057 0.456 . . . . 0.0 109.959 179.262 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 131.9 -103.64 0.54 Allowed Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.554 179.709 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.512 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -58.34 -24.31 59.37 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 117.041 0.42 . . . . 0.0 109.949 179.855 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.408 HG12 ' HA3' ' A' ' 40' ' ' GLY . 4.0 m -70.24 -40.19 77.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 121.231 0.539 . . . . 0.0 109.774 178.495 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.459 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 50.5 ttp180 -71.12 -44.96 64.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.542 179.921 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.4 p -67.16 -35.08 78.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.87 179.469 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.492 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -62.22 -55.8 25.74 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.647 -179.736 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.546 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -58.08 -39.5 78.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.899 0.381 . . . . 0.0 110.714 179.749 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.458 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.89 -46.07 90.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.512 -179.76 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 0.2 OUTLIER -70.85 -32.64 69.73 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.423 -179.041 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' A' ' 79' ' ' GLN . 46.5 m -61.79 -34.44 75.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.806 0.336 . . . . 0.0 110.996 -179.791 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.6 HD11 HD11 ' A' ' 62' ' ' LEU . 66.5 mt -59.64 -60.65 3.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.977 0.418 . . . . 0.0 110.62 179.576 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -65.34 -18.18 65.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.641 179.456 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.437 ' HB3' ' O ' ' A' ' 76' ' ' SER . 8.7 tt0 -56.88 -39.93 75.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.91 -179.897 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.506 HG21 ' HD2' ' A' ' 84' ' ' ARG . 3.2 mp -80.43 -56.77 5.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.928 179.584 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.454 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 71.03 58.56 5.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.339 -179.781 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -135.13 179.84 17.27 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.304 179.786 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.08 -22.1 64.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.809 0.338 . . . . 0.0 110.836 179.957 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.513 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -76.9 -31.42 56.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.786 -179.271 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.513 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 38.2 t -70.31 -33.76 55.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.915 0.388 . . . . 0.0 110.195 179.412 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.8 ttp180 -56.26 -21.93 26.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.062 179.961 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.33 -33.86 37.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.688 179.928 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.18 -31.03 68.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.971 179.805 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.509 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 10.0 mmm -72.21 -50.03 30.67 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.306 179.866 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.43 -35.62 65.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.168 179.4 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.463 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 11.7 tmtt? -70.27 -31.73 69.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.866 179.853 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.639 HD22 HD13 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -85.99 -28.62 24.09 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 179.845 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.46 -28.91 60.94 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.849 178.83 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -80.18 -27.76 38.86 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.077 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.3 p -109.35 25.96 11.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.68 178.827 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.488 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -49.75 113.06 1.64 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.45 -178.983 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 58.2 m -141.1 130.4 23.63 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.181 -0.304 . . . . 0.0 110.181 179.435 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.26 -130.27 12.23 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.063 -179.381 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -95.82 -15.82 22.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.732 0.301 . . . . 0.0 110.839 179.939 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.464 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.71 -42.89 62.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.437 -179.749 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.488 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 60.5 ttt180 -59.29 -60.7 3.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.01 -179.969 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.6 tttp -49.91 -24.33 2.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.25 0.548 . . . . 0.0 110.333 179.621 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.46 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.1 t -79.82 -48.56 20.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.388 179.943 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.588 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.62 -53.08 62.35 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.258 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 28.3 t -64.91 -58.99 4.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.917 -178.084 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -55.59 -38.61 69.63 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.519 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.509 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 36.7 t80 -63.34 -25.22 68.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.829 0.347 . . . . 0.0 111.231 -178.805 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 94.0 mt -56.37 -20.13 17.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.543 -179.785 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -78.56 6.23 9.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.603 -179.416 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.0 p -138.9 -53.46 0.58 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.469 179.917 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.8 p-80 . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.43 -179.788 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.654 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 CA--C 1.522 -0.123 0 CA-C-O 120.773 0.32 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.513 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 1.9 t80 -56.49 -64.82 0.74 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.725 179.798 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.522 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.36 -50.8 72.4 Favored Pre-proline 0 C--N 1.329 -0.314 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 179.563 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.654 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 53.9 Cg_exo -45.81 -25.06 2.36 Favored 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 121.933 1.756 . . . . 0.0 110.826 179.706 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.689 HD21 HG13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -82.62 -47.08 12.49 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.364 178.921 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 28' ' ' LEU . 1.0 OUTLIER -58.26 -39.33 78.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.13 178.443 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -59.81 -29.07 67.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.393 -179.21 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.9 m -64.98 -22.43 67.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.581 -179.356 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.466 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 68.0 mt -69.55 -11.74 61.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.054 -179.844 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.3 t -109.65 13.09 23.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.705 179.889 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -78.55 135.68 37.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.031 -179.862 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -58.22 -26.84 63.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.207 -179.986 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -84.84 130.85 34.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.046 179.993 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -84.04 -27.74 28.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.729 179.809 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.8 mtp180 -62.51 -42.11 99.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.585 179.537 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.4 mt -79.89 -31.57 13.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.768 179.952 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.466 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 35.6 ttm180 -65.53 -36.21 83.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.626 179.732 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -57.34 -48.81 77.67 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.072 179.818 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.31 -35.86 68.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.7 0.285 . . . . 0.0 110.944 179.611 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.417 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.7 -53.2 59.5 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.424 179.514 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.37 90.8 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.454 179.126 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.677 ' HA ' ' NH1' ' A' ' 75' ' ' ARG . 7.9 m95 -63.62 -28.55 70.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.013 -179.233 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.7 mm -98.95 -24.07 4.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.921 0.391 . . . . 0.0 111.108 179.839 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.689 HG13 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -60.84 -30.97 48.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.847 -179.315 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.514 ' HA3' HH21 ' A' ' 75' ' ' ARG . . . -61.26 -28.99 70.12 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.86 -179.744 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -59.84 -26.2 65.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.85 0.357 . . . . 0.0 110.399 179.857 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.404 ' C ' ' H ' ' A' ' 51' ' ' ASP . 47.0 m-85 -94.94 111.72 23.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.486 179.847 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -80.27 36.72 0.37 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.461 179.831 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.473 ' O ' HG23 ' A' ' 55' ' ' VAL . 20.6 m-20 -102.34 158.18 16.38 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.789 -179.698 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.72 -33.75 75.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.798 -179.189 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.513 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 18.8 ttm180 -65.84 -13.44 59.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.951 0.405 . . . . 0.0 110.558 -180.0 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.427 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -105.15 -3.03 23.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.353 179.97 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 51' ' ' ASP . 93.2 t -91.21 -34.26 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.277 -179.907 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.465 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 20.9 tt0 -60.36 -44.85 97.06 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 116.272 -0.422 . . . . 0.0 112.077 -179.864 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.554 ' O ' HD13 ' A' ' 61' ' ' LEU . 94.6 Cg_exo -45.53 -53.0 6.0 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.437 2.091 . . . . 0.0 113.578 -179.548 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.756 HD12 ' HA ' ' A' ' 73' ' ' ALA . 0.1 OUTLIER -54.27 -30.32 50.2 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.965 0.358 . . . . 0.0 111.965 -178.864 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 43.5 mm -55.12 -59.06 2.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.736 0.303 . . . . 0.0 111.584 -179.557 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -70.06 -37.16 75.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.802 -179.518 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.714 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -52.54 -55.55 21.38 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.91 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.666 HD13 HD22 ' A' ' 92' ' ' LEU . 9.3 mt -51.76 -13.92 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.609 -179.729 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -113.11 -19.15 11.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.024 179.857 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.443 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 7.9 t0 -61.18 -34.56 75.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.005 0.431 . . . . 0.0 111.422 -179.773 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.658 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 14.4 m-20 54.85 29.64 12.36 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.317 -179.707 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.507 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.0 t -83.18 0.29 46.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.383 -179.973 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.61 -78.19 1.67 Allowed Glycine 0 C--O 1.228 -0.237 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.199 -179.665 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.95 -45.2 94.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.158 0.504 . . . . 0.0 109.818 179.32 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.714 HG12 ' HG ' ' A' ' 61' ' ' LEU . 10.7 t -73.63 -46.68 47.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.514 -179.839 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.658 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 14.0 ttp180 -63.35 -59.23 4.97 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -179.357 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.4 t -50.91 -32.78 21.74 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.98 -179.353 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.56 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -54.24 -47.66 67.11 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.817 179.479 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.756 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -51.04 -32.39 21.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.656 0.265 . . . . 0.0 111.558 179.9 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.94 -60.98 2.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.686 -179.226 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.73 HH21 HE22 ' A' ' 79' ' ' GLN . 0.2 OUTLIER -61.42 -27.92 68.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.711 -179.397 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 39.3 t -62.15 -52.67 62.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.726 0.298 . . . . 0.0 111.51 -179.663 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.514 ' HA ' HG11 ' A' ' 85' ' ' VAL . 8.3 mp -55.72 -60.72 3.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.645 -179.83 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -55.57 -24.65 33.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.968 0.413 . . . . 0.0 110.566 179.644 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.73 HE22 HH21 ' A' ' 75' ' ' ARG . 2.0 mt-30 -70.87 -48.25 54.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.132 179.806 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 79.5 mt -71.97 -60.71 2.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.4 -179.494 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.446 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 67.75 121.33 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.729 -179.943 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.513 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 146.11 179.72 22.51 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.762 179.935 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -66.06 -31.72 72.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.919 0.39 . . . . 0.0 110.603 -179.97 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.557 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.59 -52.31 64.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.069 -179.744 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.557 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.1 OUTLIER -70.37 -22.88 24.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.981 0.419 . . . . 0.0 110.518 179.693 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -58.63 -22.15 55.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.382 179.503 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 90' ' ' GLU . . . -76.69 -32.26 57.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.317 179.602 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.23 -48.8 77.91 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.982 179.156 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.589 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -72.12 -24.43 61.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.556 179.115 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.496 ' N ' ' HE2' ' A' ' 89' ' ' MET . 19.8 mm-40 -66.74 -35.05 79.19 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.999 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -81.49 -28.84 33.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.815 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.767 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.5 OUTLIER -85.67 -35.03 21.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.605 0.24 . . . . 0.0 110.864 -179.288 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -55.55 -28.47 55.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.963 0.411 . . . . 0.0 110.496 179.104 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.22 -26.17 39.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.386 179.934 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 50.0 p -117.6 30.96 6.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.615 179.2 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.421 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -53.35 121.55 17.45 Favored Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 115.186 -0.915 . . . . 0.0 113.539 -178.999 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.429 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 29.4 m -154.13 130.27 10.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.833 0.349 . . . . 0.0 110.682 179.124 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.04 -158.45 25.35 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.904 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -55.35 -33.18 63.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.608 0.242 . . . . 0.0 111.247 179.972 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.716 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -48.55 -48.05 38.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.316 -179.913 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.429 ' HB2' ' N ' ' A' ' 97' ' ' THR . 72.0 ttt180 -60.23 -58.35 8.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.994 -179.618 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.541 ' HD2' HD21 ' A' ' 106' ' ' ASN . 4.6 tppp? -45.89 -24.91 0.45 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.381 -179.08 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 40.3 t -68.37 -52.98 31.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.367 179.763 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.767 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -53.41 -63.03 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.499 0.666 . . . . 0.0 112.375 -179.374 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.472 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 32.8 t -52.18 -62.83 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.779 -1.1 . . . . 0.0 113.412 -178.355 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.541 HD21 ' HD2' ' A' ' 102' ' ' LYS . 98.4 m-20 -55.45 -34.22 64.29 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -178.236 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -59.42 -28.53 67.02 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-O 120.987 0.422 . . . . 0.0 111.145 -179.031 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 15.2 mt -62.13 -14.99 42.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.61 179.949 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -79.36 5.81 11.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.863 -179.411 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 35.5 p -146.63 -34.19 0.29 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.734 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.413 ' OXT' ' HA2' ' A' ' 81' ' ' GLY . 40.8 m80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.293 -179.125 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.848 0.356 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.513 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 15.0 t80 -63.3 -37.15 86.15 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.151 0.501 . . . . 0.0 110.425 179.86 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.412 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 1.1 mp0 -63.28 -57.68 19.36 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.998 179.759 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.5 Cg_endo -56.08 -14.5 11.7 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 121.484 1.456 . . . . 0.0 110.13 179.235 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.426 ' HB3' ' O ' ' A' ' 24' ' ' PHE . 0.7 OUTLIER -86.86 -37.45 17.7 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.285 -1.325 . . . . 0.0 109.089 178.451 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 28' ' ' LEU . 3.4 tm? -75.96 -31.41 59.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.824 179.459 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -71.31 -15.47 62.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.416 179.917 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.417 ' HB3' HG22 ' A' ' 38' ' ' ILE . 65.2 m -66.45 -51.5 56.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.14 -179.125 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.504 HD21 HD22 ' A' ' 28' ' ' LEU . 2.4 pp -60.45 -7.71 2.26 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.7 0.286 . . . . 0.0 111.527 -179.329 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.9 m -88.93 19.71 3.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.85 0.357 . . . . 0.0 110.449 179.529 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -105.08 150.57 24.89 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.094 179.951 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -67.38 -12.37 60.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.678 179.526 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -76.0 153.57 36.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.651 -179.929 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.3 m95 -102.78 -32.81 9.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.082 -179.7 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.527 ' HG3' HG13 ' A' ' 38' ' ' ILE . 34.0 ptt180 -62.0 -39.49 92.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.938 179.981 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.527 HG13 ' HG3' ' A' ' 37' ' ' ARG . 40.9 mt -82.22 -32.32 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.999 0.428 . . . . 0.0 110.517 179.475 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -38.83 78.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.302 -179.988 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.53 -53.97 7.07 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.879 -179.462 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.41 -39.14 46.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.709 0.29 . . . . 0.0 111.76 -179.912 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.407 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -64.4 -33.45 75.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.24 -179.759 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.441 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -85.44 -28.88 24.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.383 -179.88 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.0 m95 -69.53 -31.54 69.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.267 -178.778 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.608 ' HA ' HD22 ' A' ' 48' ' ' ASN . 22.8 mt -99.29 -19.43 5.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.981 0.42 . . . . 0.0 111.199 -179.246 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.554 HG12 ' HA ' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -51.17 -27.53 6.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.826 -179.346 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -93.11 -22.67 26.9 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.111 -179.084 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.608 HD22 ' HA ' ' A' ' 45' ' ' ILE . 37.7 m-80 -69.84 -12.07 61.34 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 -179.589 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.419 ' HB2' ' HE2' ' A' ' 24' ' ' PHE . 22.2 m-85 -101.94 -35.66 8.91 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.747 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.436 ' HG2' HG23 ' A' ' 80' ' ' ILE . 1.4 tt0 69.61 72.06 0.24 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 0.0 110.843 179.622 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -126.68 170.53 12.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.277 179.876 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.553 ' O ' HG22 ' A' ' 55' ' ' VAL . 0.5 OUTLIER -66.43 -38.84 88.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.623 -179.292 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.458 ' HB2' ' HE1' ' A' ' 24' ' ' PHE . 0.2 OUTLIER -69.2 -9.98 55.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -179.614 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.554 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -88.59 10.61 19.88 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.902 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.553 HG22 ' O ' ' A' ' 52' ' ' GLU . 27.4 m -92.47 -49.21 13.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.851 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.525 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -60.42 -51.95 76.41 Favored Pre-proline 0 CA--C 1.533 0.297 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.963 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.525 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 71.8 Cg_exo -41.56 -53.06 3.43 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 122.404 2.069 . . . . 0.0 112.536 -179.898 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.445 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 8.4 mt -52.1 -47.87 65.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.693 -179.399 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 51.2 mt -54.76 -56.91 8.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.208 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.442 ' NZ ' ' HB2' ' A' ' 60' ' ' LYS . 0.1 OUTLIER -69.68 -16.2 63.31 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -178.876 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.885 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.6 OUTLIER -88.85 -46.26 9.08 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.303 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.845 HD13 HD11 ' A' ' 92' ' ' LEU . 7.1 mt -59.61 -15.06 16.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.176 0.512 . . . . 0.0 110.208 -179.306 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -112.31 -11.71 13.67 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.281 179.322 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.551 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 7.1 t70 -61.32 -32.12 71.98 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.772 -179.758 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.653 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 1.3 m-20 57.09 27.18 12.99 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.583 -179.82 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.522 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.5 t -85.55 -3.35 58.84 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.161 -179.941 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.83 -73.34 2.57 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.503 179.914 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -70.32 -43.53 70.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.022 0.439 . . . . 0.0 110.029 179.536 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.885 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.7 t -73.83 -33.49 37.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.386 179.949 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.701 HH21 ' H ' ' A' ' 100' ' ' ALA . 62.5 ttt180 -77.49 -53.58 7.45 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.128 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.484 ' O ' ' HG3' ' A' ' 75' ' ' ARG . 90.8 p -50.8 -55.45 16.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.572 -178.949 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -45.35 -32.3 3.71 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 121.202 -0.523 . . . . 0.0 113.071 -179.553 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.445 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -69.47 -48.83 59.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.646 0.26 . . . . 0.0 111.179 179.94 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.65 -35.77 66.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.283 -179.616 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 71' ' ' SER . 8.8 mtp85 -74.27 -34.04 63.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.319 179.874 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.76 ' HA ' HE21 ' A' ' 79' ' ' GLN . 31.0 t -61.44 -37.02 82.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.709 -179.318 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.679 HD11 HD11 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -59.95 -60.2 4.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.648 0.261 . . . . 0.0 111.072 179.944 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.405 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 10.8 pt-20 -59.44 -29.36 67.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.262 179.486 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.76 HE21 ' HA ' ' A' ' 76' ' ' SER . 21.4 mt-30 -70.67 -36.86 73.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.758 0.313 . . . . 0.0 110.761 179.647 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.436 HG23 ' HG2' ' A' ' 50' ' ' GLN . 94.2 mt -80.3 -61.51 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.528 -179.692 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.44 122.47 0.01 OUTLIER Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.664 -179.846 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.436 ' O ' HG23 ' A' ' 85' ' ' VAL . . . 145.91 171.02 15.05 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.624 -179.992 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.63 -26.97 68.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.643 0.258 . . . . 0.0 111.384 -179.752 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.508 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -62.22 -49.26 76.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.028 0.442 . . . . 0.0 110.288 179.785 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.581 HG11 ' HA ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -70.85 -23.73 24.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.16 179.947 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 82' ' ' GLY . 98.5 mtt180 -58.64 -27.76 65.03 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.871 0.367 . . . . 0.0 110.558 179.533 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 91' ' ' LYS . . . -72.34 -29.09 63.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.145 179.585 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.36 -45.39 63.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.843 179.738 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.511 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.29 -33.08 71.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.886 0.374 . . . . 0.0 110.26 179.562 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.96 -34.67 76.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.921 178.915 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 29.8 mmmt -61.0 -40.77 94.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.978 179.223 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.845 HD11 HD13 ' A' ' 62' ' ' LEU . 66.1 mt -71.21 -38.54 72.03 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.988 179.836 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.458 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -52.76 -27.7 19.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.441 179.84 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -97.49 -10.49 25.25 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 -179.404 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.473 ' OG1' ' HA ' ' A' ' 92' ' ' LEU . 47.4 p -106.16 -31.42 8.69 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.72 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.556 ' HA2' ' HD3' ' A' ' 101' ' ' ARG . . . 52.67 92.9 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.877 -179.866 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.441 ' H ' ' HB2' ' A' ' 101' ' ' ARG . 79.7 m -140.24 129.23 23.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.39 . . . . 0.0 111.575 179.934 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.439 ' HA3' HH22 ' A' ' 70' ' ' ARG . . . 38.72 -127.88 1.88 Allowed Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.548 -0.751 . . . . 0.0 113.767 179.498 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.437 ' H ' ' HD1' ' A' ' 99' ' ' PHE . 0.4 OUTLIER -92.81 -21.88 19.64 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.479 0.18 . . . . 0.0 110.982 -179.703 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.701 ' H ' HH21 ' A' ' 70' ' ' ARG . . . -49.93 -40.03 42.21 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.009 0.433 . . . . 0.0 110.654 179.815 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.556 ' HD3' ' HA2' ' A' ' 96' ' ' GLY . 30.7 tpt85 -57.27 -61.56 2.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.639 179.508 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -55.66 -39.55 71.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.155 179.392 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 99' ' ' PHE . 35.3 t -60.88 -36.69 73.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.112 179.901 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.557 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -63.42 -60.95 2.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.858 -179.169 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.555 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 58.6 t -60.89 -40.49 85.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.844 -179.205 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -71.1 -28.66 64.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.823 179.743 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.405 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 4.5 t80 -63.51 -50.31 70.11 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -177.8 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 3.2 pp -52.33 -13.32 0.33 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.496 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -78.05 5.91 8.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.962 0.41 . . . . 0.0 110.715 179.335 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.5 m -124.47 -59.6 1.45 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.08 179.94 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 53.1 p-80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.442 179.807 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.475 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.231 0.105 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 . . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.522 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -63.2 -49.68 73.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.026 0.441 . . . . 0.0 110.649 179.933 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -63.32 -53.43 53.17 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.116 179.838 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.475 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 83.7 Cg_exo -41.73 -24.57 0.27 Allowed 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 122.327 2.018 . . . . 0.0 111.961 179.554 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 70.2 mt -75.91 -57.02 4.12 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.473 178.997 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.657 HD12 HD12 ' A' ' 31' ' ' LEU . 28.5 tp -62.86 -24.56 67.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.101 179.938 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.2 -45.93 37.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 -179.598 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.2 p -63.29 -15.02 55.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.348 -179.8 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.657 HD12 HD12 ' A' ' 28' ' ' LEU . 57.0 mt -63.7 -10.96 22.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.84 0.352 . . . . 0.0 111.03 179.982 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.7 t -95.82 23.33 6.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.679 179.864 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.594 HD21 ' HB2' ' A' ' 39' ' ' ARG . 1.3 p30 -88.7 148.06 24.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.95 -179.614 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -65.6 -29.25 69.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.534 -179.386 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -77.88 163.63 25.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 0.0 111.066 -179.782 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -105.04 -24.94 12.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.594 -179.879 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 56.0 mtm180 -60.9 -39.13 88.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.193 179.736 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.7 mt -79.0 -45.57 24.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.453 -179.508 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.594 ' HB2' HD21 ' A' ' 33' ' ' ASN . 32.0 ttm180 -59.51 -41.3 89.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.23 -179.52 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.684 ' HA2' HD21 ' A' ' 61' ' ' LEU . . . -65.09 -62.84 4.59 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.001 -179.534 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.92 -24.74 2.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.745 0.307 . . . . 0.0 111.187 179.984 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.423 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -63.07 -55.01 29.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.758 179.465 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.403 ' HA ' ' CG2' ' A' ' 46' ' ' ILE . . . -68.02 -22.51 64.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.957 0.408 . . . . 0.0 110.716 179.71 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.404 ' CD1' ' HA3' ' A' ' 72' ' ' GLY . 4.3 m95 -56.91 -47.11 81.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.588 -179.967 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.47 ' N ' HD12 ' A' ' 45' ' ' ILE . 4.4 mp -99.5 -20.69 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.0 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.656 HG23 ' HB1' ' A' ' 54' ' ' ALA . 4.1 tt -55.43 -39.21 52.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -178.269 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.509 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -75.45 -11.44 84.29 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.512 -179.079 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -70.69 -10.98 60.63 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.149 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -95.59 -4.19 45.01 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.403 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.567 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.9 OUTLIER 46.41 56.27 6.54 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 179.494 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -127.3 151.29 48.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.893 0.377 . . . . 0.0 110.886 179.723 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.466 ' O ' HG12 ' A' ' 55' ' ' VAL . 9.4 pt-20 -59.8 -22.9 62.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.833 179.717 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.45 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -65.82 -30.64 71.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.643 179.685 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.656 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -102.18 30.54 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.471 -178.967 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.556 HG13 ' N ' ' A' ' 56' ' ' GLU . 9.9 p -91.39 -54.33 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.62 -179.964 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.556 ' N ' HG13 ' A' ' 55' ' ' VAL . 10.5 tt0 -61.0 -49.7 87.89 Favored Pre-proline 0 CA--C 1.536 0.406 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.797 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.5 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 81.5 Cg_exo -43.53 -36.73 7.26 Favored 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.5 2.133 . . . . 0.0 113.023 -179.313 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.656 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 27.5 mt -71.24 -47.14 59.0 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.07 -179.658 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.43 ' HA ' HD21 ' A' ' 62' ' ' LEU . 25.3 mt -59.4 -49.38 83.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.969 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.08 -26.81 64.17 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -177.759 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.684 HD21 ' HA2' ' A' ' 40' ' ' GLY . 21.8 tp -90.08 -30.62 17.58 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -178.236 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.612 HD11 HD22 ' A' ' 92' ' ' LEU . 4.0 pp -68.49 -8.9 45.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.121 0.486 . . . . 0.0 110.703 -179.124 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -112.32 0.27 15.64 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.018 179.298 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -61.92 -31.76 72.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.793 -179.668 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.553 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 14.6 t70 59.77 24.8 13.76 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.684 179.576 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.38 -20.61 43.65 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.028 0.442 . . . . 0.0 110.076 179.392 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 128.45 -110.03 1.08 Allowed Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.726 179.49 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -56.86 -23.97 48.19 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.846 0.355 . . . . 0.0 110.084 -179.949 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.589 ' HB ' HD11 ' A' ' 61' ' ' LEU . 3.7 m -69.15 -37.33 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-O 121.35 0.595 . . . . 0.0 110.013 179.298 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.553 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 3.8 ttm180 -63.0 -53.52 52.71 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.529 179.776 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 72.1 m -67.17 -38.7 85.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.424 179.935 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.404 ' HA3' ' CD1' ' A' ' 44' ' ' TRP . . . -52.53 -61.76 6.42 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.617 -179.668 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.656 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -59.06 -34.76 72.33 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.684 0.278 . . . . 0.0 111.073 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.412 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.2 -58.04 9.96 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.964 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 10.2 ptp180 -55.09 -34.39 63.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.507 -179.02 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.634 ' HA ' HE21 ' A' ' 79' ' ' GLN . 49.9 m -57.16 -34.03 68.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.641 0.258 . . . . 0.0 111.192 179.963 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.4 mp -60.47 -61.08 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.753 0.311 . . . . 0.0 110.977 179.592 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.424 ' HG2' ' HB2' ' A' ' 107' ' ' TYR . 42.9 mt-10 -64.47 -19.23 65.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.274 0.559 . . . . 0.0 110.102 179.073 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.634 HE21 ' HA ' ' A' ' 76' ' ' SER . 8.7 tt0 -70.78 -29.45 65.66 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.705 179.929 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.567 HG23 ' HG3' ' A' ' 50' ' ' GLN . 85.3 mt -84.52 -60.18 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.103 179.961 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.5 123.43 0.04 OUTLIER Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.623 179.908 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 137.45 172.88 12.69 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.576 179.802 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.25 -22.07 27.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.006 0.431 . . . . 0.0 111.074 179.826 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.582 ' HD3' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.94 -63.09 1.37 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.302 -179.872 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.546 HG21 ' HB ' ' A' ' 80' ' ' ILE . 20.3 t -70.67 -21.11 22.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.991 179.687 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.465 ' HA ' ' SD ' ' A' ' 89' ' ' MET . 68.3 mtt180 -53.31 -24.16 11.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.769 -179.529 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.87 -36.47 28.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.409 179.197 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.52 -39.33 70.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.872 -179.987 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.502 ' SD ' ' HB3' ' A' ' 108' ' ' LEU . 19.1 ptt? -63.75 -38.8 92.45 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -179.745 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -68.05 -26.49 65.88 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.446 178.656 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? -72.36 -41.94 65.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.483 179.403 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.612 HD22 HD11 ' A' ' 62' ' ' LEU . 8.8 mt -65.37 -38.42 89.98 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.604 179.917 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.75 -29.65 40.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.734 179.556 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -83.19 -24.62 32.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.352 179.049 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.3 p -114.58 31.49 6.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.178 179.367 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.531 ' HA3' HH11 ' A' ' 101' ' ' ARG . . . -45.96 99.15 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.698 -0.683 . . . . 0.0 113.291 -179.355 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.7 m -146.78 130.74 17.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.738 0.304 . . . . 0.0 110.28 179.618 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.87 -144.97 33.15 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.436 -0.888 . . . . 0.0 111.685 -179.386 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.45 -16.01 22.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.782 0.325 . . . . 0.0 110.547 179.604 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.437 ' HB1' HD13 ' A' ' 62' ' ' LEU . . . -55.79 -29.47 59.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.456 179.701 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.531 HH11 ' HA3' ' A' ' 96' ' ' GLY . 16.0 tpt180 -67.36 -57.67 6.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.996 178.844 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -49.38 -34.7 16.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.955 179.004 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.412 HG21 ' HB1' ' A' ' 74' ' ' ALA . 38.5 t -61.25 -55.45 24.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.15 179.785 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.565 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -56.18 -61.64 2.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.859 -179.277 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.482 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 45.1 t -50.76 -52.91 15.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.943 -179.304 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -71.13 -19.66 62.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.305 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.443 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 3.0 t80 -64.31 -51.83 61.49 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -177.721 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.502 ' HB3' ' SD ' ' A' ' 89' ' ' MET . 1.9 pp -52.07 -14.99 0.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.076 -178.982 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -72.41 3.33 4.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.727 0.299 . . . . 0.0 110.62 179.56 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.1 p -141.51 -47.95 0.39 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.268 -179.845 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 43.7 p-80 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.518 -179.971 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.479 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 120.94 0.4 . . . . 0.0 110.497 . . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.701 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 4.2 t80 -63.45 -39.49 94.61 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.951 -179.962 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.428 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 39.1 mt-10 -57.27 -55.13 47.49 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.228 -179.312 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.479 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 91.8 Cg_exo -37.54 -30.24 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 C-N-CA 122.627 2.218 . . . . 0.0 111.997 179.079 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.575 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 22.7 mt -71.28 -58.71 3.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.828 179.212 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.569 ' HA ' HD12 ' A' ' 31' ' ' LEU . 41.9 tp -62.8 -21.45 65.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.896 179.997 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -79.55 -47.76 14.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.669 -179.905 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.8 m -66.41 -13.3 60.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.76 -179.758 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.569 HD12 ' HA ' ' A' ' 28' ' ' LEU . 46.8 mt -62.59 -10.27 11.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.658 0.266 . . . . 0.0 111.344 -179.733 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 35.9 m -89.96 6.88 40.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.893 179.933 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.763 HD21 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -83.4 141.01 32.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.145 0.498 . . . . 0.0 111.327 -179.827 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.88 -9.57 45.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.855 -179.745 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -78.61 147.53 33.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.815 0.34 . . . . 0.0 111.108 -179.495 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.8 p-90 -98.62 -37.31 9.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.345 -179.792 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.2 tpt180 -59.51 -43.26 93.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.167 -179.877 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.7 mt -78.07 -49.48 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.219 -179.784 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.763 ' HB2' HD21 ' A' ' 33' ' ' ASN . 42.8 ttp180 -54.87 -30.92 59.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.853 179.824 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.09 -58.92 6.25 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.52 -179.926 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.56 -27.73 2.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.774 0.321 . . . . 0.0 111.329 -179.942 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.437 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.32 -51.96 66.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 179.797 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.554 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -73.17 -31.01 63.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.174 179.867 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.6 m95 -55.92 -37.64 69.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.441 -179.632 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.445 ' HA ' HD22 ' A' ' 48' ' ' ASN . 47.5 mt -99.56 -22.91 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.078 0.466 . . . . 0.0 110.907 -179.626 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.555 HG12 ' HA ' ' A' ' 54' ' ' ALA . 0.0 OUTLIER -51.35 -39.56 21.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.33 -178.853 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -76.86 -25.7 64.09 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.655 -0.783 . . . . 0.0 113.767 -178.868 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.445 HD22 ' HA ' ' A' ' 45' ' ' ILE . 47.5 m-80 -70.82 -2.05 13.6 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -178.769 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.457 ' HB2' ' HE2' ' A' ' 24' ' ' PHE . 22.4 m-30 -112.71 -12.47 13.37 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.437 -0.505 . . . . 0.0 112.2 -179.449 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.524 ' HG2' HG23 ' A' ' 80' ' ' ILE . 0.6 OUTLIER 53.21 68.93 0.76 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.796 0.332 . . . . 0.0 111.212 179.331 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -127.48 164.25 22.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.869 0.366 . . . . 0.0 111.026 179.963 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -63.34 -43.72 96.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.78 179.564 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -6.53 21.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.29 -179.991 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.701 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -93.89 1.44 56.36 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.037 0.446 . . . . 0.0 111.041 -178.926 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.7 t -91.34 -49.13 13.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.24 -178.728 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.472 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 43.6 tt0 -60.23 -48.79 93.27 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.105 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.472 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 93.6 Cg_exo -43.06 -42.93 9.66 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.381 2.054 . . . . 0.0 112.873 -179.878 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.48 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 4.0 mt -66.35 -36.68 83.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.265 -179.284 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 29.2 mm -59.45 -59.03 4.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.192 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -70.05 -20.79 63.22 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.355 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.667 ' HG ' ' HB ' ' A' ' 69' ' ' VAL . 5.3 mp -83.38 -46.06 12.99 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -178.385 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.479 HD13 HD22 ' A' ' 92' ' ' LEU . 52.9 mt -61.37 -10.9 8.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.091 0.472 . . . . 0.0 110.5 -179.338 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.75 -17.05 13.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.285 179.126 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -62.09 -38.84 90.4 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.936 -179.68 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.566 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 5.3 m-20 57.74 27.39 14.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.712 -179.947 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.81 -25.67 59.18 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.003 0.43 . . . . 0.0 110.326 179.557 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 120.7 -82.12 0.34 Allowed Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.408 179.861 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.74 -33.23 75.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.295 0.569 . . . . 0.0 109.613 179.179 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.667 ' HB ' ' HG ' ' A' ' 61' ' ' LEU . 3.2 m -71.91 -42.14 69.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.473 -179.767 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.566 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 25.7 ttp180 -75.48 -47.57 26.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.076 -179.172 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 46.6 t -58.81 -50.29 74.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.482 179.605 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.9 -51.04 56.13 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.918 179.486 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.48 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -56.52 -33.42 66.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.673 0.273 . . . . 0.0 110.977 179.364 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.91 -54.19 45.39 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.54 -179.546 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.41 ' H ' ' HG2' ' A' ' 75' ' ' ARG . 10.2 ptp180 -69.76 -19.5 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.732 -179.589 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.548 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 59.8 m -58.74 -47.59 84.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.576 -179.863 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.468 ' HA ' HG21 ' A' ' 85' ' ' VAL . 6.3 mp -56.44 -54.9 40.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.846 -179.973 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.459 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 47.0 mt-10 -49.07 -34.0 12.76 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.422 179.463 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.548 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 18.9 mt-30 -69.91 -41.62 74.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.015 -179.997 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.524 HG23 ' HG2' ' A' ' 50' ' ' GLN . 88.4 mt -69.3 -61.02 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.943 179.645 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.49 113.83 0.01 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.119 -0.562 . . . . 0.0 112.989 179.658 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.433 ' O ' HG12 ' A' ' 85' ' ' VAL . . . 156.01 175.2 26.73 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.781 179.709 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.26 -23.34 61.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.841 0.353 . . . . 0.0 110.802 179.724 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.639 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.83 -45.48 61.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.046 -179.796 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.639 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 8.8 p -71.05 -26.47 27.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.231 0.538 . . . . 0.0 110.647 179.761 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.429 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 6.1 ttt180 -53.76 -28.76 36.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.798 179.581 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.18 -32.12 73.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.717 179.71 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.18 -57.89 10.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.343 -179.972 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.577 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.15 -24.61 65.0 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.822 -179.886 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.402 ' N ' ' SD ' ' A' ' 89' ' ' MET . 2.1 tm-20 -63.89 -44.19 93.77 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.119 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -72.22 -22.22 61.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.114 179.533 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.534 HD21 ' O ' ' A' ' 100' ' ' ALA . 0.3 OUTLIER -86.57 -28.54 23.25 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 120.81 0.338 . . . . 0.0 110.269 179.978 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.0 -19.15 65.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.948 179.667 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -84.56 -24.9 29.04 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.177 179.619 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 42.5 p -120.38 19.06 12.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.893 179.101 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -49.75 121.27 9.02 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.271 -179.263 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.6 t -142.59 130.66 21.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.842 0.354 . . . . 0.0 110.987 179.556 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.85 -136.53 46.42 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.677 -179.943 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.502 ' O ' HG23 ' A' ' 103' ' ' VAL . 48.1 t80 -66.25 -34.86 78.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.786 0.327 . . . . 0.0 111.012 179.997 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.534 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.59 -33.84 34.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.979 -179.59 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.0 ttp180 -72.63 -55.36 6.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.512 -179.408 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -49.25 -21.64 0.86 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.233 0.54 . . . . 0.0 110.484 179.722 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 99' ' ' PHE . 55.2 t -71.01 -58.77 4.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.609 179.81 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.577 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.88 -47.57 82.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.276 0.56 . . . . 0.0 112.368 -179.278 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.533 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 40.2 t -64.91 -51.5 65.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.342 -0.844 . . . . 0.0 112.878 -178.042 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -64.0 -45.36 89.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.671 0.272 . . . . 0.0 111.519 -179.248 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.459 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 61.1 t80 -60.44 -22.55 63.56 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.68 -179.049 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.533 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.0 OUTLIER -55.13 -18.11 5.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.089 179.884 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -71.47 -1.3 12.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.813 179.691 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 4.0 m -145.45 32.75 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.443 -179.981 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.1 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.961 179.84 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.61 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . . . . . . 0 N--CA 1.463 0.178 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 . . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.574 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -52.25 -50.17 62.59 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.975 0.417 . . . . 0.0 110.463 179.553 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.495 ' HA ' HD23 ' A' ' 28' ' ' LEU . 3.7 mt-10 -63.36 -57.87 18.31 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.802 179.636 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.61 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 74.6 Cg_exo -43.73 -30.88 3.1 Favored 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 122.077 1.851 . . . . 0.0 111.554 179.795 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.574 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 36.6 mt -62.8 -56.85 13.75 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.354 178.918 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.588 HD22 ' HB2' ' A' ' 53' ' ' ARG . 0.9 OUTLIER -69.82 -19.6 63.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.126 179.515 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -73.33 -39.57 65.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.781 179.552 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.0 m -66.42 -7.18 17.7 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.116 179.778 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.49 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 96.4 mt -61.24 -19.87 62.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.914 0.388 . . . . 0.0 110.479 179.626 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 83.4 p -92.51 12.05 24.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.074 179.968 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -72.55 139.15 47.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.777 -179.762 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.39 -31.78 73.03 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.855 -179.942 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -77.39 147.97 35.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.495 179.782 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 25.8 p-90 -89.44 -40.24 12.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.463 -179.473 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -60.28 -25.52 65.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.913 0.387 . . . . 0.0 110.723 179.756 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.3 mm -81.08 -47.77 19.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.087 179.974 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.49 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 49.4 ttp180 -63.73 -22.08 66.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.877 179.901 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.48 ' HA2' ' HA ' ' A' ' 69' ' ' VAL . . . -69.04 -59.16 6.09 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.606 -179.885 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' ' 44' ' ' TRP . . . -50.26 -20.37 1.04 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.704 0.288 . . . . 0.0 111.597 180.0 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.86 -55.09 37.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.354 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.592 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -73.81 -25.47 60.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.175 -179.959 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.403 ' HB2' ' HA ' ' A' ' 41' ' ' ALA . 6.7 m95 -55.46 -36.95 67.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.211 -179.586 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.0 mt -100.1 -26.14 3.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.039 0.447 . . . . 0.0 111.128 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.592 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 0.9 OUTLIER -56.3 -46.61 81.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.34 -178.873 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.406 ' N ' HG22 ' A' ' 46' ' ' ILE . . . -61.35 -21.61 60.08 Favored Glycine 0 CA--C 1.518 0.281 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.391 -179.058 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -70.71 -20.9 62.62 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 -179.064 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -92.08 -28.78 16.92 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.142 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.72 27.31 14.71 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 179.367 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.511 ' O ' HG23 ' A' ' 55' ' ' VAL . 12.0 t70 -96.12 170.03 9.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.767 0.317 . . . . 0.0 111.272 -179.866 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -54.12 -52.09 62.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.038 179.672 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.588 ' HB2' HD22 ' A' ' 28' ' ' LEU . 3.2 ptt180 -61.6 -8.47 4.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.225 179.66 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.543 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -104.97 -21.0 13.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.92 0.391 . . . . 0.0 111.067 -179.691 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 51' ' ' ASP . 69.5 t -73.58 -54.17 16.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.694 -179.633 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.452 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 25.5 tt0 -54.21 -47.7 96.57 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -179.527 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.501 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 97.2 Cg_exo -42.08 -46.92 7.02 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 122.489 2.126 . . . . 0.0 112.561 179.623 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.553 HD13 HD22 ' A' ' 77' ' ' LEU . 6.1 mt -63.48 -42.34 98.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.938 -179.592 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.0 mm -51.46 -54.84 10.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.345 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -70.06 -47.89 60.09 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.278 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.682 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.1 mp -60.17 -40.55 90.35 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.054 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.637 HD11 HD21 ' A' ' 77' ' ' LEU . 37.2 mt -56.77 -15.71 5.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.287 0.565 . . . . 0.0 109.999 -179.555 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -99.57 -30.98 11.83 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.293 178.235 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -62.21 87.77 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.174 178.957 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.465 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 16.6 m-20 -73.91 41.91 0.13 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.246 -178.798 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.9 t -85.75 -30.82 22.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.782 0.325 . . . . 0.0 111.125 179.763 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 126.46 -106.54 0.85 Allowed Glycine 0 C--O 1.228 -0.267 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.996 -179.686 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -46.7 -29.73 2.03 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.631 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.682 HG12 ' HG ' ' A' ' 61' ' ' LEU . 47.0 t -68.19 -54.98 18.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.963 179.559 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.465 ' HE ' ' HA ' ' A' ' 65' ' ' ASP . 0.2 OUTLIER -66.79 -54.69 20.07 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.257 179.736 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.3 m -50.95 -31.3 17.37 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.536 -179.614 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.46 -46.12 95.0 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.429 179.922 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.438 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . . . -70.21 -32.94 71.06 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 -179.837 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.34 -61.53 2.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.817 0.342 . . . . 0.0 111.648 -179.189 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 75' ' ' ARG . 6.4 ptp180 -60.68 -20.48 61.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.746 -179.425 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.664 ' HA ' HE21 ' A' ' 79' ' ' GLN . 50.2 m -67.15 -36.03 80.96 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.27 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.637 HD21 HD11 ' A' ' 62' ' ' LEU . 4.2 mm? -54.81 -61.05 2.56 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.724 0.297 . . . . 0.0 111.416 179.748 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.5 ' HG2' ' HD1' ' A' ' 107' ' ' TYR . 37.6 mt-10 -56.36 -41.28 75.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.889 179.567 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.664 HE21 ' HA ' ' A' ' 76' ' ' SER . 20.3 mt-30 -62.32 -40.96 98.06 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -178.772 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 72.9 mt -60.74 -59.77 3.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -179.176 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.492 ' H ' HG21 ' A' ' 85' ' ' VAL . . . 174.59 -124.92 1.05 Allowed Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.09 -1.053 . . . . 0.0 113.392 179.938 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.456 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . -146.64 -66.67 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.411 -0.899 . . . . 0.0 113.748 -179.099 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.59 -27.08 63.83 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.335 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.565 ' HD3' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -85.05 -48.34 9.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.863 0.363 . . . . 0.0 110.517 -179.277 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.579 HG12 HD13 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -70.85 -20.77 22.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.723 178.858 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -47.28 -29.66 2.6 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.637 179.088 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.74 -36.84 50.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.75 179.963 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.91 -47.64 84.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.919 179.615 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.664 ' HE3' ' HG3' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -67.6 -30.29 69.84 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.509 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.664 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 22.1 mt-10 -66.49 -33.89 76.71 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.122 179.171 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -70.72 -38.67 73.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.113 179.788 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.54 HD21 ' O ' ' A' ' 100' ' ' ALA . 0.1 OUTLIER -82.05 -23.66 35.74 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.652 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.31 -26.36 68.73 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.298 179.024 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -80.22 -26.76 38.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.708 179.887 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 58.3 p -112.54 23.02 14.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.171 178.54 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.452 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -56.07 116.1 6.92 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.064 -0.971 . . . . 0.0 113.508 -178.958 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.8 t -147.79 130.32 15.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.741 0.305 . . . . 0.0 110.72 179.05 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.07 -142.19 48.41 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.734 -179.833 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -62.54 -29.45 70.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 111.009 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.54 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -56.24 -37.63 70.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.505 -179.747 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.452 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 18.0 ttp180 -70.91 -55.55 8.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.622 -179.594 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 57.7 tttp -47.67 -23.18 0.63 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.163 0.506 . . . . 0.0 110.948 -179.872 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.431 HG11 HD22 ' A' ' 62' ' ' LEU . 17.8 t -68.4 -60.43 2.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.73 179.903 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.5 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.6 -56.28 24.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.38 -179.156 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.424 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 19.4 t -56.42 -63.17 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.026 -178.245 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 15.0 m120 -57.08 -27.72 61.99 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -178.674 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.5 ' HD1' ' HG2' ' A' ' 78' ' ' GLU . 4.4 t80 -59.83 -31.09 69.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.362 . . . . 0.0 110.359 179.768 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.424 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 16.6 mt -52.65 -23.77 7.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.107 179.619 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -58.87 -8.75 1.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.215 179.747 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.5 p -93.19 -54.0 3.89 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.553 179.443 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 61.7 m80 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.322 -0.847 . . . . 0.0 110.932 179.843 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mpp? . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.777 0.322 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 66.08 146.82 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.299 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -92.49 -0.26 57.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.01 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -105.38 -6.51 19.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.996 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -142.84 96.47 2.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.784 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -99.31 -35.68 9.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.259 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -88.98 144.15 26.36 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.991 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.8 p -175.71 104.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.393 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 59.49 19.02 7.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.58 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 12.1 ptp180 -65.97 104.86 1.2 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 20.7 t70 72.41 -10.89 0.87 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.946 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.604 HG12 ' H ' ' A' ' 13' ' ' SER . 3.5 t -84.14 171.78 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.535 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.604 ' H ' HG12 ' A' ' 12' ' ' VAL . 34.5 t -156.79 -24.69 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.681 0.276 . . . . 0.0 111.028 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.668 HG22 ' H ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -88.11 -168.53 2.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.467 179.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.668 ' H ' HG22 ' A' ' 14' ' ' THR . . . -94.87 -67.67 0.84 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.502 HD13 ' N ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -78.33 -11.72 59.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.985 -179.027 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.502 ' N ' HD13 ' A' ' 16' ' ' LEU . 46.1 t -45.56 -52.24 10.78 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -174.75 96.43 0.08 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.794 0.331 . . . . 0.0 111.542 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 24.7 mmt -133.7 -43.16 0.83 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.774 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.12 12.69 38.51 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.337 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -170.14 -59.29 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.825 0.345 . . . . 0.0 111.132 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -66.12 -16.75 64.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.416 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.438 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -99.35 -1.92 37.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.038 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.46 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 2.5 t80 -63.2 -51.57 65.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.244 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -63.4 -55.25 37.08 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.832 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.438 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 44.2 Cg_exo -50.91 -24.9 14.64 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 121.782 1.654 . . . . 0.0 110.349 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.666 HD21 HG13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -76.4 -41.75 46.77 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 114.207 -1.361 . . . . 0.0 109.218 178.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 31' ' ' LEU . 16.5 tp -70.47 -27.14 63.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.207 178.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -65.93 -41.11 91.77 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.124 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -61.38 -17.77 55.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.035 -0.53 . . . . 0.0 112.008 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.788 HD12 HD12 ' A' ' 28' ' ' LEU . 80.1 mt -69.37 -11.89 61.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.788 0.328 . . . . 0.0 111.333 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.2 t -109.82 0.82 18.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.825 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -67.92 139.03 56.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.722 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -67.53 -24.03 65.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.315 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.67 139.79 33.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.919 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.1 p-90 -88.1 -26.4 22.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -64.08 -41.55 97.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.004 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.7 mt -80.18 -41.54 21.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.811 0.338 . . . . 0.0 111.122 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.536 ' HE ' HG21 ' A' ' 69' ' ' VAL . 54.1 ttp180 -59.48 -24.52 63.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.592 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.31 -63.61 3.85 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.635 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.61 -37.9 6.05 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.652 0.263 . . . . 0.0 111.258 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.438 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -57.45 -54.21 49.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.323 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.35 -30.81 71.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.703 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -68.47 -34.45 75.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.906 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.0 mt -99.37 -19.36 5.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.343 . . . . 0.0 111.762 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.666 HG13 HD21 ' A' ' 27' ' ' LEU . 3.9 tt -58.38 -34.92 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.24 -17.11 80.27 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.138 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -70.58 -7.15 41.87 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -99.18 -22.17 15.77 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.499 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.7 mp0 55.96 54.4 8.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 111.391 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -127.47 166.92 17.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.809 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -63.6 -29.11 70.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.663 ' HD2' HD22 ' A' ' 28' ' ' LEU . 1.1 ttp180 -66.33 -11.69 52.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.965 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.458 ' HA ' ' HG2' ' A' ' 57' ' ' PRO . . . -104.94 -13.59 15.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 86.8 t -68.9 -51.31 45.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.088 -179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.488 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 21.1 tt0 -59.75 -49.63 90.76 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.488 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.2 Cg_exo -41.22 -52.24 3.6 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.371 2.047 . . . . 0.0 112.898 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.627 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 5.2 mt -60.03 -36.93 78.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.384 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.6 mm -55.02 -59.83 2.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.875 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.44 ' HG3' HD13 ' A' ' 61' ' ' LEU . 3.9 ptpp? -70.76 -40.12 72.87 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.719 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -57.86 -51.58 69.03 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.465 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.799 HD13 HD22 ' A' ' 92' ' ' LEU . 33.5 mt -55.96 -10.34 0.77 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.716 0.294 . . . . 0.0 111.491 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -107.02 -20.32 13.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.991 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.419 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 6.5 m-20 -61.13 -40.3 93.27 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.714 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.446 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 29.5 t70 62.33 27.35 16.34 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.316 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.519 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 4.7 m -84.31 17.12 2.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.477 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.79 -96.58 0.68 Allowed Glycine 0 C--O 1.227 -0.337 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.747 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.09 -43.8 64.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.036 0.446 . . . . 0.0 110.61 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.719 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.8 t -73.35 -39.09 54.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.049 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.501 ' HG2' ' HA ' ' A' ' 62' ' ' LEU . 3.0 tmm_? -77.98 -63.6 1.35 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.668 0.27 . . . . 0.0 111.435 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 48.9 m -51.55 -32.25 27.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.305 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.438 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -63.4 -38.39 96.31 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.437 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.627 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -64.02 -37.37 87.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.704 0.288 . . . . 0.0 111.042 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.16 -57.14 14.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.762 -179.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 7.4 ptm85 -58.65 -26.93 64.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.618 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.2 m -58.49 -39.85 81.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.452 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.651 ' HA ' HG11 ' A' ' 85' ' ' VAL . 6.1 mp -59.79 -58.33 9.03 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.744 0.307 . . . . 0.0 110.631 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.456 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 54.1 mt-10 -48.96 -31.17 6.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.338 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -68.67 -41.93 78.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.141 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.499 HG23 ' HG3' ' A' ' 50' ' ' GLN . 35.3 mt -74.35 -60.87 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 63.14 117.6 0.01 OUTLIER Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.977 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.449 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 145.43 -173.05 25.98 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.753 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -69.45 -30.2 68.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.814 0.34 . . . . 0.0 110.902 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.553 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -52.85 -63.24 1.21 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.851 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.651 HG11 ' HA ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -70.93 -20.61 21.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.9 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 55.3 ttp180 -56.78 -26.35 57.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.253 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.16 -25.67 27.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.215 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.62 69.41 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.695 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.464 ' HB2' ' CB ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -69.09 -26.79 65.11 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.249 179.629 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 41.7 mt-10 -69.78 -32.26 70.64 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -76.76 -28.7 55.82 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.622 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.799 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -84.54 -30.08 25.39 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.515 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.57 -20.27 66.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.337 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -80.33 -26.86 38.54 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.674 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 51.3 p -118.2 24.4 10.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.827 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.425 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -55.85 116.41 7.19 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.338 -0.846 . . . . 0.0 113.261 -179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.3 t -140.52 130.24 24.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.828 0.347 . . . . 0.0 110.842 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.86 -135.67 51.79 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.631 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -67.64 -32.01 72.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.618 0.247 . . . . 0.0 111.315 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.548 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.84 -28.75 37.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.687 -179.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.425 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 21.9 ttp180 -75.22 -55.23 5.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.431 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -48.25 -26.95 2.19 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.21 0.529 . . . . 0.0 110.256 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.417 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 37.5 t -59.5 -60.04 3.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.868 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.62 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -62.59 -56.55 16.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.433 0.635 . . . . 0.0 111.957 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.589 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 54.8 t -52.38 -54.61 14.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 114.82 -1.082 . . . . 0.0 113.146 -178.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -70.74 -31.48 68.32 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.456 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 21.6 t80 -63.7 -50.96 67.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 4.3 pp -52.42 -15.02 0.55 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.456 -178.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -62.2 -13.71 30.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.088 0.47 . . . . 0.0 110.149 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.02 12.97 6.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.77 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.044 -0.979 . . . . 0.0 111.074 179.88 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtt . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.787 0.327 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -111.61 76.01 0.95 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.239 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 51.34 82.98 0.06 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.089 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -163.12 -63.39 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.83 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.401 ' OD1' HG21 ' A' ' 8' ' ' VAL . 65.0 t30 -130.26 97.08 4.32 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.792 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -137.91 174.5 10.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.7 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.428 ' HA ' ' HD3' ' A' ' 10' ' ' ARG . 40.7 m95 59.05 25.89 14.44 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.563 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.445 HG13 ' HA ' ' A' ' 22' ' ' GLU . 24.1 t -101.51 145.5 11.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.651 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.511 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 46.3 ttp180 61.04 13.58 4.74 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.789 179.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' A' ' 7' ' ' TRP . 30.8 mtm180 -66.0 104.36 1.11 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.3 t70 68.31 -3.86 1.21 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.193 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.511 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 41.3 t -77.37 129.69 37.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.897 0.38 . . . . 0.0 111.389 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.419 ' H ' ' H ' ' A' ' 14' ' ' THR . 89.0 p -164.39 -18.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.461 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.419 ' H ' ' H ' ' A' ' 13' ' ' SER . 58.5 p -137.72 -9.52 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.743 179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.11 -1.25 56.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.38 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.41 HD23 ' N ' ' A' ' 16' ' ' LEU . 2.3 pt? -46.94 -17.09 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.891 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 61.6 m -46.13 -44.57 15.87 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.81 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.449 HH12 HG23 ' A' ' 45' ' ' ILE . 18.0 tpp180 -173.47 100.34 0.12 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.387 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 94.9 mmm -132.77 -28.53 1.58 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.601 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 111.22 -133.17 11.35 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.168 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -70.5 -17.58 62.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.937 0.399 . . . . 0.0 110.53 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.445 ' HA ' HG13 ' A' ' 8' ' ' VAL . 27.9 mt-10 -72.42 -29.57 63.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.882 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -102.83 6.19 39.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.559 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.556 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -60.96 -53.86 52.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.154 0.502 . . . . 0.0 110.124 179.661 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -63.23 -54.92 40.97 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.013 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 91.9 Cg_exo -43.33 -26.38 0.93 Allowed 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.228 1.952 . . . . 0.0 111.458 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.556 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 43.5 mt -74.68 -55.3 6.03 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.937 178.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.608 HD12 HD11 ' A' ' 31' ' ' LEU . 38.1 tp -61.53 -20.96 63.81 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.599 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -80.68 -36.81 31.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.715 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.479 ' HB3' HG22 ' A' ' 38' ' ' ILE . 60.0 m -66.22 -42.42 88.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.859 -179.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.608 HD11 HD12 ' A' ' 28' ' ' LEU . 4.1 pp -63.32 -6.27 4.46 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.2 m -90.32 22.12 3.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.066 0.46 . . . . 0.0 110.525 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -117.5 144.58 44.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.029 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -65.89 -8.76 23.96 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.305 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -77.36 120.69 22.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.947 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -70.68 -35.88 73.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.827 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 53.1 ttp180 -60.11 -54.63 43.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.254 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.479 HG22 ' HB3' ' A' ' 30' ' ' SER . 64.0 mt -65.96 -45.65 90.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.804 0.335 . . . . 0.0 111.0 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.499 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.3 ttm180 -63.2 -20.69 65.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.58 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.65 -66.48 2.27 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.625 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.6 -40.31 19.03 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.688 0.28 . . . . 0.0 111.18 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.99 -52.72 63.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.075 0.464 . . . . 0.0 110.235 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.448 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -63.31 -36.19 82.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.665 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -63.16 -26.28 68.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.471 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.449 HG23 HH12 ' A' ' 18' ' ' ARG . 62.8 mt -99.26 -19.74 5.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.005 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.589 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.9 OUTLIER -55.39 -39.54 53.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.535 -179.738 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.19 -16.48 73.17 Favored Glycine 0 C--N 1.329 0.193 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.744 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.697 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.7 OUTLIER -64.0 -45.93 86.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.831 0.348 . . . . 0.0 110.379 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.443 ' C ' ' H ' ' A' ' 51' ' ' ASP . 85.2 m-85 -85.54 111.87 20.41 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.659 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.764 ' H ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -74.67 35.02 0.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.377 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.443 ' H ' ' C ' ' A' ' 49' ' ' PHE . 35.6 t70 -100.66 155.31 17.96 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.84 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.488 ' O ' HG12 ' A' ' 55' ' ' VAL . 12.2 pt-20 -63.06 -23.58 67.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.544 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.459 ' HD3' HD22 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -57.69 -41.15 81.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.81 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.589 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -97.37 24.55 6.41 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 52' ' ' GLU . 2.7 p -91.41 -37.75 9.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.941 0.4 . . . . 0.0 111.062 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.521 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 24.8 tt0 -60.45 -51.13 82.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.98 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.571 ' HG2' HG12 ' A' ' 46' ' ' ILE . 88.5 Cg_exo -42.81 -52.36 4.67 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.397 2.065 . . . . 0.0 112.761 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.59 HD13 HD23 ' A' ' 77' ' ' LEU . 49.6 mt -56.73 -41.23 77.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.596 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 25.3 mm -53.17 -60.12 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -71.87 -31.04 66.06 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.63 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -66.08 -44.19 85.15 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.657 HD13 HD11 ' A' ' 92' ' ' LEU . 12.0 mt -62.68 -8.96 7.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.967 0.413 . . . . 0.0 110.564 -178.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -126.95 -6.2 6.15 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.27 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.43 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 3.7 t70 -61.17 -33.05 72.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.28 0.562 . . . . 0.0 110.745 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 42.7 m-20 58.75 25.75 13.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.292 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.454 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.1 m -86.04 5.59 32.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.623 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.98 -103.95 2.63 Favored Glycine 0 C--O 1.227 -0.306 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.44 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -50.44 -39.79 48.58 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.182 0.515 . . . . 0.0 110.127 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.63 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.4 t -67.98 -38.29 79.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.539 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 27.0 ttp180 -76.61 -58.87 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.294 -179.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 62.0 p -50.87 -30.18 13.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.326 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.17 -37.02 94.23 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.616 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.455 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -77.08 -36.92 55.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.61 0.243 . . . . 0.0 111.507 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.45 ' HB2' ' HE1' ' A' ' 99' ' ' PHE . . . -54.98 -49.59 71.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.799 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 7.3 ptp180 -73.68 -33.8 64.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.283 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.529 ' HA ' HE21 ' A' ' 79' ' ' GLN . 19.8 m -56.5 -39.97 74.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.034 -179.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.59 HD23 HD13 ' A' ' 58' ' ' LEU . 90.1 mt -55.51 -59.58 4.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.747 0.308 . . . . 0.0 110.53 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -49.08 -29.99 5.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.804 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.529 HE21 ' HA ' ' A' ' 76' ' ' SER . 24.9 mt-30 -68.68 -41.71 78.86 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.949 0.404 . . . . 0.0 110.257 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.544 HG23 ' HG3' ' A' ' 50' ' ' GLN . 71.6 mt -69.22 -61.48 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.12 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.405 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 58.94 111.3 0.01 OUTLIER Glycine 0 CA--C 1.518 0.27 0 C-N-CA 121.156 -0.545 . . . . 0.0 113.155 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.415 ' H ' ' HB3' ' A' ' 111' ' ' HIS . . . 165.83 174.26 35.15 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.593 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.93 -22.59 66.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.834 0.349 . . . . 0.0 110.547 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.601 ' HD3' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -75.76 -33.7 60.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.619 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.601 ' N ' ' HD3' ' A' ' 84' ' ' ARG . 3.4 t -68.53 -32.68 56.29 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-O 121.333 0.587 . . . . 0.0 109.756 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 86' ' ' ARG . 9.3 ttt180 -52.48 -26.61 13.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.777 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.29 -41.61 66.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.503 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.04 -43.07 88.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.116 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.437 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.98 -36.27 77.67 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.786 0.327 . . . . 0.0 110.387 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.62 -31.38 72.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.078 0.466 . . . . 0.0 109.976 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -65.59 -39.1 91.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.85 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.69 HD12 ' HB2' ' A' ' 104' ' ' ALA . 29.4 mt -70.94 -40.23 72.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.562 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.46 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -55.79 -22.34 23.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.937 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -92.26 -23.43 19.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.978 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 71.5 p -121.64 39.01 3.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.822 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.413 ' CA ' ' HD3' ' A' ' 101' ' ' ARG . . . -38.42 104.67 0.03 OUTLIER Glycine 0 C--N 1.332 0.353 0 CA-C-N 115.761 -0.654 . . . . 0.0 113.611 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.2 p -144.8 132.18 20.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.838 0.351 . . . . 0.0 110.927 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.69 -143.58 46.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.477 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.45 ' HE1' ' HB2' ' A' ' 74' ' ' ALA . 10.6 p90 -84.16 -24.29 30.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.698 0.285 . . . . 0.0 110.819 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.624 ' HB1' HD13 ' A' ' 92' ' ' LEU . . . -44.9 -36.8 3.51 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.47 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.46 ' NE ' ' HA ' ' A' ' 93' ' ' ALA . 14.1 tpt180 -64.3 -61.88 1.96 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -54.46 -33.37 59.51 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.201 0.524 . . . . 0.0 110.261 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 43.3 t -65.19 -44.7 95.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.075 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.69 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -64.99 -59.02 4.63 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 61.1 t -55.15 -62.68 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.612 -178.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -55.46 -38.21 68.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.723 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.405 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 9.5 t80 -58.82 -44.66 90.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.906 0.384 . . . . 0.0 111.644 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.436 ' O ' HD12 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -51.1 -17.74 0.7 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.026 -178.522 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -61.11 -8.94 3.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 111.004 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 56.1 p -122.29 -41.8 2.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.179 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.415 ' HB3' ' H ' ' A' ' 82' ' ' GLY . 71.6 m80 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.809 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.1 mtm . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.745 0.307 . . . . 0.0 110.962 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.96 26.69 10.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.249 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -92.9 -71.14 0.67 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.864 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -100.27 -44.64 5.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.922 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -95.15 102.06 13.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.053 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -110.67 -62.72 1.49 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.3 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -36.79 13.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.265 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.475 HG12 ' H ' ' A' ' 9' ' ' ARG . 1.7 t 49.6 -141.2 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.321 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.519 HH11 ' HG3' ' A' ' 26' ' ' PRO . 57.3 ttp180 -81.88 -7.21 59.59 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.647 0.261 . . . . 0.0 111.305 -179.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.414 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 62.9 ttt180 -58.17 129.87 43.98 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 30.9 m-20 66.31 14.7 9.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.89 0.376 . . . . 0.0 110.606 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 40.3 t -133.09 145.64 33.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.831 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 98.9 p -160.87 7.49 0.08 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.378 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.9 m -131.74 32.06 4.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.939 0.4 . . . . 0.0 111.075 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.447 ' HB1' ' HB2' ' A' ' 19' ' ' MET . . . -88.9 -2.45 58.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.242 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.622 ' HG ' ' HB1' ' A' ' 23' ' ' ALA . 5.4 mp -69.4 -18.76 63.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.505 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.2 t -47.14 -51.18 18.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.824 0.345 . . . . 0.0 111.044 -179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.403 ' H ' ' H ' ' A' ' 19' ' ' MET . 32.1 ttm180 -176.39 -7.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.362 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.447 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 4.3 mtp -57.95 -38.28 75.67 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.569 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 58.31 -170.6 4.44 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.795 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 61.31 -79.55 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.714 0.292 . . . . 0.0 111.18 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -55.54 -41.63 73.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.698 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.622 ' HB1' ' HG ' ' A' ' 16' ' ' LEU . . . -105.66 18.68 21.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.703 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.462 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 2.5 t80 -60.63 -46.54 89.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.508 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.401 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.42 -54.08 47.0 Favored Pre-proline 0 N--CA 1.466 0.329 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.431 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.519 ' HG3' HH11 ' A' ' 9' ' ' ARG . 53.0 Cg_exo -46.32 -23.88 2.28 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.902 1.735 . . . . 0.0 111.011 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.657 HD21 HG13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -83.96 -46.83 11.65 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 114.322 -1.308 . . . . 0.0 110.128 179.667 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.676 HD12 HD12 ' A' ' 31' ' ' LEU . 15.1 tp -69.13 -16.93 63.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.363 179.147 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -75.61 -36.57 60.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.771 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.4 m -66.34 -20.28 66.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.825 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.676 HD12 HD12 ' A' ' 28' ' ' LEU . 91.2 mt -65.86 -9.52 29.82 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.574 0.226 . . . . 0.0 111.542 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.5 m -101.5 11.69 38.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.079 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -71.47 148.04 47.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.018 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.43 -18.28 65.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.965 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -86.76 162.48 17.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.791 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -102.86 -39.62 6.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.798 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -58.74 -37.5 76.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.894 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.2 mm -61.59 -41.57 90.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.717 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.441 ' HB2' HG22 ' A' ' 69' ' ' VAL . 76.4 mtt180 -62.45 -24.5 67.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.398 179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.62 -64.36 3.63 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.858 -0.686 . . . . 0.0 112.197 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.74 -33.8 36.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.781 0.324 . . . . 0.0 110.948 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.34 -55.46 15.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.583 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.421 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -62.62 -26.01 68.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.742 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.435 ' NE1' ' HA2' ' A' ' 72' ' ' GLY . 5.3 m95 -70.63 -32.82 70.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.135 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.534 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 41.4 mt -99.46 -22.88 4.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.945 0.403 . . . . 0.0 111.41 -179.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.657 HG13 HD21 ' A' ' 27' ' ' LEU . 4.4 tt -61.02 -37.56 77.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.19 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -78.08 -14.8 81.9 Favored Glycine 0 C--N 1.33 0.216 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.221 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.534 ' ND2' ' HA ' ' A' ' 45' ' ' ILE . 51.0 m-20 -70.74 -14.76 62.56 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -93.76 -10.31 34.67 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.454 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.7 OUTLIER 50.51 61.54 3.16 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.815 0.341 . . . . 0.0 111.412 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -127.93 161.68 28.54 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.164 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.69 -36.15 82.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.723 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -65.71 -9.06 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.046 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.462 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -102.99 -13.67 16.79 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.866 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 41.7 t -72.15 -38.87 64.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.439 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.503 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 26.4 tt0 -57.07 -51.51 81.15 Favored Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.624 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.508 ' HG2' HD13 ' A' ' 46' ' ' ILE . 89.6 Cg_exo -41.97 -51.64 4.5 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.261 1.974 . . . . 0.0 112.156 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.448 HD23 ' HG ' ' A' ' 77' ' ' LEU . 8.4 mp -52.69 -37.5 59.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.961 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.2 mm -56.58 -61.44 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -72.4 -10.41 59.76 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.505 ' HA ' ' HB2' ' A' ' 64' ' ' ASP . 1.8 mp -89.37 -49.39 6.73 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.615 HD13 HD22 ' A' ' 92' ' ' LEU . 11.4 mt -56.45 -15.52 4.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.851 0.358 . . . . 0.0 111.181 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -113.71 -11.82 12.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.505 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.7 OUTLIER -61.08 -46.09 92.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.056 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.591 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 14.4 t70 63.08 24.45 14.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.152 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.468 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.6 m -86.2 7.58 24.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.012 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.89 -108.47 3.52 Favored Glycine 0 C--O 1.229 -0.204 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.425 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -48.81 -30.9 6.25 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.257 0.551 . . . . 0.0 109.634 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 66' ' ' SER . 58.8 t -72.08 -50.81 34.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.783 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.591 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 38.3 ttp180 -68.2 -62.45 1.39 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.108 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.5 m -51.04 -27.67 8.52 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.957 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.435 ' HA2' ' NE1' ' A' ' 44' ' ' TRP . . . -57.84 -56.2 26.44 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.73 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.442 ' CB ' ' HA ' ' A' ' 58' ' ' LEU . . . -56.2 -46.15 79.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.854 0.359 . . . . 0.0 110.907 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.12 -27.18 63.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.775 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.414 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 27.3 ttt-85 -83.8 -34.6 24.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.814 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.463 ' HA ' HE21 ' A' ' 79' ' ' GLN . 47.5 m -61.98 -39.47 92.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.621 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.464 HD23 HG22 ' A' ' 85' ' ' VAL . 1.1 mt -59.25 -59.24 5.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.717 0.294 . . . . 0.0 111.411 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -48.93 -38.86 24.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.706 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.463 HE21 ' HA ' ' A' ' 76' ' ' SER . 41.4 mt-30 -70.81 -47.79 57.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.628 0.251 . . . . 0.0 111.37 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.581 HG21 ' HB ' ' A' ' 85' ' ' VAL . 90.0 mt -61.43 -60.63 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.36 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 53.88 70.55 0.9 Allowed Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.579 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -152.45 164.71 30.7 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.552 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -65.17 -27.64 68.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.848 0.356 . . . . 0.0 110.859 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.512 ' H ' ' CD ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -69.28 -50.99 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.875 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.581 ' HB ' HG21 ' A' ' 80' ' ' ILE . 9.9 p -70.77 -23.87 24.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.272 0.558 . . . . 0.0 110.331 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -53.46 -29.99 38.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.806 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 91' ' ' LYS . . . -65.87 -31.41 72.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.267 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.07 -51.38 69.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.968 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.552 ' HE3' ' O ' ' A' ' 104' ' ' ALA . 3.4 ppp? -69.72 -24.87 63.63 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.822 0.344 . . . . 0.0 110.387 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.432 ' N ' ' SD ' ' A' ' 89' ' ' MET . 28.2 mt-10 -68.17 -40.16 82.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.967 179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 46.4 mmtm -78.78 -21.71 47.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.119 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.615 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -86.69 -30.33 21.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.786 0.327 . . . . 0.0 110.207 179.779 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.19 -26.81 67.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.975 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -80.11 -25.64 39.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.083 0.468 . . . . 0.0 110.288 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.2 p -117.4 24.42 11.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.349 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.472 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -58.24 121.68 27.04 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.153 -179.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 92.3 m -139.69 130.42 25.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.57 -0.315 . . . . 0.0 110.76 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.32 -133.8 52.6 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.759 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.54 ' O ' HG23 ' A' ' 103' ' ' VAL . 48.0 t80 -66.41 -33.78 76.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.787 0.327 . . . . 0.0 111.146 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.576 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.28 -38.69 54.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.014 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.472 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 39.9 ttt180 -70.44 -60.02 2.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.811 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -46.57 -25.2 0.65 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.155 0.503 . . . . 0.0 110.749 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 99' ' ' PHE . 37.1 t -67.7 -60.52 2.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.259 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.552 ' O ' ' HE3' ' A' ' 89' ' ' MET . . . -50.36 -59.65 3.77 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.5 t -58.4 -64.27 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -55.56 -38.34 69.21 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.42 ' HB3' ' O ' ' A' ' 103' ' ' VAL . 12.1 t80 -58.84 -48.19 82.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.867 0.365 . . . . 0.0 111.445 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -21.48 6.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.807 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -54.98 -21.3 11.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.864 0.364 . . . . 0.0 110.992 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.9 p -95.25 -49.11 5.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.146 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 73.4 m80 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.865 -179.98 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 mtt . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 120.634 0.254 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.81 14.57 1.37 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.407 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -145.37 133.01 20.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.649 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 62.45 -86.12 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.127 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -70.86 122.01 19.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.837 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.404 ' H ' ' H ' ' A' ' 7' ' ' TRP . 59.4 tptt -167.9 -18.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.404 ' H ' ' H ' ' A' ' 6' ' ' LYS . 14.8 p-90 -161.48 21.68 0.12 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.266 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 40.3 t -76.57 77.56 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.138 0.494 . . . . 0.0 111.287 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.584 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 5.3 mpt_? 51.96 20.04 1.14 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.806 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -70.21 104.68 2.7 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.9 t70 69.08 13.25 8.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.805 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.584 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 12.9 p -55.62 -26.91 20.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.042 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.6 t -168.8 -75.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.565 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.455 ' O ' ' HG3' ' A' ' 19' ' ' MET . 22.2 p -116.98 170.98 8.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.504 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -96.15 -69.5 0.75 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.414 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.2 pt? -86.26 -13.86 45.48 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.417 ' HB3' ' CB ' ' A' ' 14' ' ' THR . 31.8 t -83.33 -51.31 7.53 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -144.88 93.28 2.38 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.661 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 7.9 mtt -134.41 -4.65 2.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.906 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.69 -109.09 2.7 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.595 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -84.18 -28.34 27.43 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.943 0.402 . . . . 0.0 110.689 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -79.17 4.97 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.317 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.661 ' HB2' ' HB2' ' A' ' 19' ' ' MET . . . -99.88 -22.53 15.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.938 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.559 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -57.21 -50.83 71.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.702 -179.422 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.503 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.38 -55.71 33.25 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.634 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.503 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 87.6 Cg_exo -45.56 -27.81 3.8 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 122.093 1.862 . . . . 0.0 111.438 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 47.5 mt -71.17 -50.16 36.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.845 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.614 HD12 HD12 ' A' ' 31' ' ' LEU . 10.4 tp -73.08 -18.41 61.31 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.448 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -81.53 -39.52 24.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.389 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.5 t -66.39 -10.83 47.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.729 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.614 HD12 HD12 ' A' ' 28' ' ' LEU . 58.4 mt -63.51 -21.08 66.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.711 0.291 . . . . 0.0 111.116 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.9 p -104.52 8.77 35.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.844 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -64.65 150.37 47.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.149 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -67.86 -44.43 77.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.829 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -77.73 133.52 38.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.003 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.1 m0 -79.71 -22.44 43.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.675 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -61.99 -48.31 80.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.47 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.6 mt -75.46 -37.61 38.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.666 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.543 ' HG2' ' HA ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -61.64 -32.65 72.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.225 179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.44 -57.38 7.47 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.307 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.21 -29.18 1.48 Allowed 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 120.798 0.332 . . . . 0.0 111.287 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.67 -54.85 42.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.366 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.79 -29.29 70.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.673 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -65.29 -34.41 78.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.242 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.434 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 29.1 mt -101.05 -20.82 5.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.855 0.359 . . . . 0.0 111.599 -179.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.568 HD13 ' HG2' ' A' ' 57' ' ' PRO . 1.3 tt -60.42 -36.89 72.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.84 -8.23 72.32 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.244 -0.979 . . . . 0.0 112.703 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.644 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.7 OUTLIER -70.78 -22.75 62.34 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.568 0.21 . . . . 0.0 111.568 -179.503 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -88.24 -32.86 18.32 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.722 0.268 . . . . 0.0 111.722 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.595 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 36.3 mt-30 66.22 19.04 11.06 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.593 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -86.11 169.41 13.15 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.759 0.314 . . . . 0.0 110.804 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.67 -36.82 85.52 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.613 -179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 32.0 ttm180 -68.05 -9.88 49.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.815 0.34 . . . . 0.0 111.066 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -104.15 4.54 34.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.165 0.507 . . . . 0.0 110.41 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.3 t -91.12 -33.23 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.7 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.555 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.4 tm-20 -60.21 -50.24 86.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.766 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.568 ' HG2' HD13 ' A' ' 46' ' ' ILE . 82.4 Cg_exo -46.86 -49.4 12.46 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.304 2.003 . . . . 0.0 112.471 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.516 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 6.6 mt -58.84 -28.25 65.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.716 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.8 mm -63.38 -61.3 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 64' ' ' ASP . 21.8 ttpt -72.02 -39.17 69.36 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.609 ' HG ' HG12 ' A' ' 69' ' ' VAL . 2.4 mp -55.54 -51.32 67.46 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -178.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.496 HD11 HD21 ' A' ' 77' ' ' LEU . 49.9 mt -62.19 -10.19 9.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.109 0.48 . . . . 0.0 110.358 -179.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -113.91 -15.06 12.41 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.025 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' A' ' 60' ' ' LYS . 10.3 t0 -61.09 -47.72 84.98 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.383 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.507 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 5.7 m-20 62.55 28.15 16.57 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.458 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.455 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 48.1 t -84.8 -16.99 39.58 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 111.089 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 113.98 -104.82 1.5 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.026 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.16 -28.26 10.63 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.46 0.648 . . . . 0.0 109.301 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.609 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.8 t -73.67 -54.99 13.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.812 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.507 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 32.7 ttp180 -66.94 -61.52 1.9 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.047 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.0 t -52.06 -31.56 30.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.933 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.34 -35.33 90.8 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.321 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.516 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -84.68 -23.43 29.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.741 0.305 . . . . 0.0 111.045 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.407 ' O ' HD12 ' A' ' 77' ' ' LEU . . . -58.51 -52.87 63.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.153 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.537 ' H ' ' HG3' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -79.44 -17.28 54.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.012 179.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.514 ' HB2' HH21 ' A' ' 75' ' ' ARG . 48.3 t -63.48 -45.94 88.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.886 0.374 . . . . 0.0 110.497 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.602 HD13 ' HE1' ' A' ' 89' ' ' MET . 0.4 OUTLIER -56.84 -57.44 12.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.227 179.56 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -55.21 -34.45 63.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.53 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.52 ' NE2' HH22 ' A' ' 75' ' ' ARG . 10.7 tt0 -68.73 -23.78 64.39 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.964 0.412 . . . . 0.0 110.16 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.595 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 57.2 mt -81.95 -61.02 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.447 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 56.6 92.82 0.01 OUTLIER Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.718 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 173.26 172.13 38.51 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.595 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -63.69 -26.45 68.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.834 0.35 . . . . 0.0 110.948 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.561 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -61.78 -57.46 11.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.826 -179.684 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.478 HG21 ' HA ' ' A' ' 77' ' ' LEU . 9.9 p -70.68 -23.7 24.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.648 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.44 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 3.2 tmt_? -51.35 -33.46 29.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.375 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.18 -32.46 56.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.642 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.14 -36.5 73.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.748 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.629 ' HE2' ' HA ' ' A' ' 104' ' ' ALA . 1.6 mmm -69.8 -53.47 18.1 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.317 -0.401 . . . . 0.0 109.93 179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -54.22 -29.13 45.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.298 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -76.87 -32.08 57.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.55 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.549 HD23 ' HB2' ' A' ' 104' ' ' ALA . 1.3 tp -86.74 -29.44 22.37 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.936 0.398 . . . . 0.0 110.427 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.25 -31.77 65.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.887 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -80.16 -24.71 40.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.319 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.7 p -118.35 33.09 5.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.555 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.441 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -48.23 124.79 11.68 Favored Glycine 0 N--CA 1.449 -0.44 0 CA-C-N 114.951 -1.022 . . . . 0.0 114.085 -178.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 20.2 m -143.33 130.31 20.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.493 -0.354 . . . . 0.0 110.162 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 65.74 -142.41 43.65 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.347 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -81.6 -22.23 37.83 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.709 0.29 . . . . 0.0 110.933 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.49 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -49.92 -41.08 45.28 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.909 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.441 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 61.6 ttt180 -56.14 -60.88 2.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.739 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -54.69 -25.92 30.25 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.562 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.6 t -72.4 -50.83 32.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.742 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.629 ' HA ' ' HE2' ' A' ' 89' ' ' MET . . . -53.26 -55.53 23.76 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.8 t -60.81 -61.78 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.724 -178.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.424 ' HA ' ' OE2' ' A' ' 109' ' ' GLU . 13.1 m120 -56.35 -36.33 68.65 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -61.91 -30.74 71.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.963 0.411 . . . . 0.0 111.232 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.5 mt -56.27 -15.95 4.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.977 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.424 ' OE2' ' HA ' ' A' ' 106' ' ' ASN . 0.5 OUTLIER -75.23 1.21 14.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.434 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 61.4 p -111.81 -61.6 1.68 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.742 0.306 . . . . 0.0 111.023 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.814 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 120.781 0.325 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.43 -87.61 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.711 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -61.54 -36.22 79.96 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.873 0.368 . . . . 0.0 110.921 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.03 -168.62 1.32 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.791 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -55.91 109.34 0.56 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.759 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -139.06 -30.26 0.74 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.523 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 70.1 m95 -98.57 114.0 26.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.905 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.587 HG13 ' HG2' ' A' ' 9' ' ' ARG . 7.7 p -164.78 -40.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.802 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.587 ' HG2' HG13 ' A' ' 8' ' ' VAL . 29.8 ptt180 -173.85 -21.48 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.622 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 91.0 mtt180 -57.71 115.02 2.55 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 12.3 t70 77.24 -49.18 0.53 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.718 0.636 . . . . 0.0 110.594 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.2 t -67.68 92.86 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.673 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.7 t -81.17 -16.93 51.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.217 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.611 ' HB ' ' HB2' ' A' ' 17' ' ' SER . 68.6 p -57.94 135.64 56.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.809 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.42 ' HB3' HD12 ' A' ' 16' ' ' LEU . . . -95.58 -67.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.503 ' N ' HD12 ' A' ' 16' ' ' LEU . 4.7 mp -82.61 -16.16 49.44 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -178.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.611 ' HB2' ' HB ' ' A' ' 14' ' ' THR . 14.8 m -70.74 -50.45 36.01 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.301 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.455 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 0.8 OUTLIER -172.05 122.48 0.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.833 0.349 . . . . 0.0 111.412 -179.491 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.549 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 63.8 mmm -133.34 -26.26 1.67 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.517 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.436 ' C ' ' H ' ' A' ' 22' ' ' GLU . . . 83.5 86.6 0.83 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.519 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 65.99 -4.99 0.58 Allowed 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 122.343 0.257 . . . . 0.0 111.536 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 19' ' ' MET . 13.0 mm-40 -103.61 -14.63 16.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.016 0.436 . . . . 0.0 110.108 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.585 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.03 -1.44 25.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.416 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 4.6 t80 -57.85 -60.19 4.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.406 -179.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.527 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.5 OUTLIER -63.51 -53.32 52.84 Favored Pre-proline 0 N--CA 1.466 0.328 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.863 -178.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.585 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 9.7 Cg_endo -51.56 -25.41 19.47 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 121.777 1.652 . . . . 0.0 110.513 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.624 HD21 HD13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -75.77 -40.59 55.0 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.78 -1.1 . . . . 0.0 108.128 178.064 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.632 HD22 ' HD3' ' A' ' 53' ' ' ARG . 6.1 tp -73.84 -20.46 60.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.137 177.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 25' ' ' GLU . 3.2 tm-20 -77.69 -40.97 39.66 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.3 -0.863 . . . . 0.0 110.599 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.7 m -61.76 -19.55 62.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.263 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.523 HD12 HD12 ' A' ' 28' ' ' LEU . 79.1 mt -66.85 -9.35 36.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.729 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.0 t -109.6 18.9 19.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.872 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.409 HD22 ' HA ' ' A' ' 33' ' ' ASN . 9.6 m120 -85.36 135.12 34.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.939 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -58.56 -25.51 62.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.786 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -83.67 153.69 24.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.729 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -104.89 -25.88 12.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -63.01 -36.59 84.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.867 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.5 mt -81.19 -36.94 15.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.8 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -63.91 -31.84 73.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -56.6 -57.08 21.29 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.354 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.34 -38.82 59.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.691 0.281 . . . . 0.0 110.977 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.43 -50.62 71.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.383 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.433 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -65.24 -35.29 80.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.745 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.4 m95 -66.1 -32.13 73.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.926 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.506 ' HA ' HD22 ' A' ' 48' ' ' ASN . 38.7 mm -99.41 -23.14 4.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.624 HD13 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -54.52 -37.82 39.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -178.536 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -67.68 -19.51 71.25 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.867 -0.682 . . . . 0.0 113.769 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.506 HD22 ' HA ' ' A' ' 45' ' ' ILE . 42.1 m-80 -70.69 -0.89 9.72 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -101.64 -26.26 13.58 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.491 ' HG2' HG23 ' A' ' 80' ' ' ILE . 19.6 mt-30 62.11 18.3 9.9 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -93.43 167.84 11.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.614 0.245 . . . . 0.0 110.692 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -62.32 -31.8 72.47 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.812 0.339 . . . . 0.0 110.684 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.632 ' HD3' HD22 ' A' ' 28' ' ' LEU . 34.4 ttm180 -69.2 -9.52 53.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.011 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.439 ' HA ' HD12 ' A' ' 46' ' ' ILE . . . -100.24 -7.54 24.54 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.207 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.4 t -91.14 -39.18 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.577 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.543 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 21.5 tt0 -60.51 -50.85 83.7 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.543 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 89.1 Cg_exo -47.8 -45.73 23.43 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.11 1.874 . . . . 0.0 112.029 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.63 HD22 ' HA ' ' A' ' 73' ' ' ALA . 4.6 mt -57.95 -31.47 66.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.639 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.407 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 50.9 mm -57.41 -61.54 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -11.75 60.79 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.684 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.3 mp -84.85 -49.63 8.24 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.715 HD13 HD22 ' A' ' 92' ' ' LEU . 8.8 mt -59.4 -10.05 2.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.17 0.51 . . . . 0.0 110.289 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 59' ' ' ILE . 8.2 pt-20 -115.42 -17.22 11.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.18 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -61.07 -32.81 72.45 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.151 0.501 . . . . 0.0 110.943 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.622 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 1.5 m-20 50.4 30.08 4.33 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.722 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.488 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 47.5 t -85.94 2.41 46.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.776 0.322 . . . . 0.0 111.094 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.28 -89.13 1.6 Allowed Glycine 0 C--O 1.228 -0.244 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.694 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -58.76 -38.55 78.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.932 0.396 . . . . 0.0 110.224 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.684 HG12 ' HG ' ' A' ' 61' ' ' LEU . 14.3 t -73.77 -49.23 36.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.233 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.622 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 45.9 ttp180 -62.48 -58.3 8.12 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.927 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 33.4 t -51.96 -26.76 11.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.771 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -60.12 -39.77 96.27 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.542 -0.837 . . . . 0.0 111.544 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.63 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -71.26 -49.96 37.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.847 0.356 . . . . 0.0 110.42 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.97 -25.69 58.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.274 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -84.16 -32.46 24.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.502 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.504 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 66.9 m -67.08 -44.78 79.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.008 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.555 ' HA ' HG21 ' A' ' 85' ' ' VAL . 2.5 mp -55.67 -59.64 4.56 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.513 -179.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -49.28 -36.14 19.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.714 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.504 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 19.9 mt-30 -66.07 -57.87 6.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.812 0.339 . . . . 0.0 111.186 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.491 HG23 ' HG2' ' A' ' 50' ' ' GLN . 92.0 mt -53.92 -60.34 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.412 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 59.73 88.45 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.41 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 175.12 172.46 40.06 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.48 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -65.91 -22.48 66.51 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.747 0.308 . . . . 0.0 111.267 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.548 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -63.37 -62.84 1.41 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.472 -179.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.555 HG21 ' HA ' ' A' ' 77' ' ' LEU . 3.4 p -70.85 -21.18 22.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.728 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -50.66 -46.38 58.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.376 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.32 -24.0 26.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.061 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 85' ' ' VAL . . . -71.46 -42.55 68.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.402 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.57 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -71.88 -30.82 65.8 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.446 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -66.7 -39.27 88.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.649 179.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -77.57 -23.0 50.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.131 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.715 HD22 HD13 ' A' ' 62' ' ' LEU . 1.2 tp -85.99 -26.98 25.14 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.34 -24.09 66.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.412 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -80.29 -26.49 38.88 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.411 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 64.3 p -117.01 20.23 13.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.556 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.488 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -53.7 121.74 19.35 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 115.095 -0.957 . . . . 0.0 113.27 -179.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.8 m -142.67 130.13 21.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.79 0.328 . . . . 0.0 110.835 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 57.84 -129.34 49.39 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.845 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.475 ' O ' HG23 ' A' ' 103' ' ' VAL . 57.2 t80 -70.25 -35.04 73.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.727 0.299 . . . . 0.0 111.204 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.59 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -52.0 -35.96 48.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 112.049 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.488 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 45.4 ttt180 -72.21 -57.27 4.38 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -48.28 -21.99 0.6 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.122 0.487 . . . . 0.0 110.762 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 99' ' ' PHE . 32.4 t -68.35 -60.4 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.645 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.587 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -54.75 -54.75 37.9 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.502 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 57.4 t -59.02 -61.38 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.586 -178.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -56.1 -37.92 70.05 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -58.73 -29.19 66.51 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.502 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -51.51 -28.96 14.97 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -75.22 6.78 3.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.662 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.5 m -100.22 -61.13 1.41 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.685 0.279 . . . . 0.0 111.465 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.94 -179.749 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 ttp . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.774 0.321 . . . . 0.0 110.827 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.79 -168.52 1.61 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.115 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.0 t70 63.06 -83.54 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.406 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.12 85.35 0.36 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.216 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.418 ' OD1' ' HB ' ' A' ' 8' ' ' VAL . 50.3 t-20 179.35 -63.32 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.291 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.0 tptp 65.23 -80.05 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.685 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -121.55 100.01 6.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.153 0.501 . . . . 0.0 112.324 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.576 HG22 ' HG3' ' A' ' 9' ' ' ARG . 5.5 p -101.65 138.19 26.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.85 178.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.576 ' HG3' HG22 ' A' ' 8' ' ' VAL . 72.8 mtp180 67.32 -75.41 0.06 Allowed 'General case' 0 N--CA 1.464 0.245 0 O-C-N 123.257 0.348 . . . . 0.0 110.97 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.444 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 36.9 ptt180 -48.2 161.4 0.11 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.77 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.444 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 20.5 t70 73.33 -5.65 1.92 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.521 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.494 HG12 ' H ' ' A' ' 14' ' ' THR . 99.3 t -138.04 -62.88 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.189 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.4 p 63.66 26.97 14.74 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.475 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.494 ' H ' HG12 ' A' ' 12' ' ' VAL . 30.9 p -113.01 -172.14 2.0 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.585 0.231 . . . . 0.0 110.921 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.1 -43.33 95.63 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.841 0.353 . . . . 0.0 111.293 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.666 HD13 HD21 ' A' ' 27' ' ' LEU . 13.9 mt -58.23 -43.77 87.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.549 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.553 ' HB2' ' HA ' ' A' ' 9' ' ' ARG . 83.0 p -87.0 -8.2 57.41 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.73 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 14' ' ' THR . 21.2 tpp180 -65.98 -55.74 15.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.486 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.403 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 10.3 mtp -82.38 -6.69 59.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.915 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.71 -135.8 22.29 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.906 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -67.97 -0.37 4.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.799 0.333 . . . . 0.0 111.022 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -88.95 -27.13 21.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.72 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.585 ' HB3' ' O ' ' A' ' 16' ' ' LEU . . . -87.95 5.75 39.14 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.272 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.535 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.0 t80 -61.76 -40.9 96.76 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.306 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.31 -55.56 34.97 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.469 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.508 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 65.9 Cg_exo -38.16 -29.57 0.14 Allowed 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 122.655 2.237 . . . . 0.0 112.124 178.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.666 HD21 HD13 ' A' ' 16' ' ' LEU . 28.4 mt -66.46 -58.67 4.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.39 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 31' ' ' LEU . 24.3 tp -66.74 -20.18 65.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.201 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -79.35 -34.64 41.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.849 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.53 ' HB3' HG22 ' A' ' 38' ' ' ILE . 75.6 m -65.77 -24.68 66.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.46 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 28' ' ' LEU . 82.5 mt -61.63 -12.06 14.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.791 0.329 . . . . 0.0 110.988 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.5 m -91.13 20.32 5.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.135 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -103.91 138.94 39.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.901 0.381 . . . . 0.0 111.258 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -67.75 -15.53 63.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.679 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.413 ' HB3' HD12 ' A' ' 38' ' ' ILE . 17.1 t70 -76.12 152.18 36.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.107 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 15.5 m0 -95.7 -36.14 11.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.095 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.4 ' HD2' ' O ' ' A' ' 37' ' ' ARG . 5.0 tmm_? -58.85 -38.2 78.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.187 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.53 HG22 ' HB3' ' A' ' 30' ' ' SER . 41.0 mt -75.11 -34.52 31.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.721 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -60.7 -55.85 28.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.276 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.3 -57.12 21.52 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.954 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.73 -36.24 4.87 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.766 0.317 . . . . 0.0 111.509 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.475 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.77 -53.33 57.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.044 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.32 -25.77 63.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.606 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.4 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 7.1 m95 -60.36 -42.54 95.98 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.681 0.622 . . . . 0.0 112.681 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.6 mm -99.35 -23.59 4.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.638 HD13 ' HG2' ' A' ' 57' ' ' PRO . 5.6 tt -59.87 -33.95 54.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -178.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.58 -27.13 69.21 Favored Glycine 0 CA--C 1.518 0.22 0 C-N-CA 120.707 -0.759 . . . . 0.0 113.254 -179.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -70.73 0.72 6.47 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -94.67 -27.41 15.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.66 ' HG3' ' HA ' ' A' ' 80' ' ' ILE . 14.9 mp0 62.35 26.04 15.55 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.234 0.54 . . . . 0.0 110.778 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.407 ' O ' HG23 ' A' ' 55' ' ' VAL . 2.9 m-20 -102.57 166.31 10.59 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.121 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -65.56 -34.83 79.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.16 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.525 ' HG3' HD22 ' A' ' 28' ' ' LEU . 34.2 ttm180 -67.34 -10.02 46.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.56 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -104.82 0.36 28.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.633 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 51' ' ' ASP . 57.4 t -90.69 -50.16 13.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.541 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.549 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.3 tm-20 -58.62 -49.38 93.77 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.958 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.638 ' HG2' HD13 ' A' ' 46' ' ' ILE . 72.8 Cg_exo -49.83 -27.44 15.75 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.32 2.013 . . . . 0.0 112.762 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.666 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 23.4 mt -74.23 -54.1 8.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.097 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.476 ' HA ' HD12 ' A' ' 62' ' ' LEU . 44.7 mm -49.66 -48.21 20.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.875 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -70.02 -30.16 67.4 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 -179.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.639 ' HG ' HG12 ' A' ' 69' ' ' VAL . 4.1 tp -89.82 -17.99 27.09 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.631 HD13 HD22 ' A' ' 92' ' ' LEU . 14.1 mt -70.43 -14.38 62.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.016 0.436 . . . . 0.0 110.828 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -115.12 6.75 15.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.03 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -61.11 -32.21 71.9 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.244 0.545 . . . . 0.0 110.841 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.511 ' HB2' HH21 ' A' ' 70' ' ' ARG . 18.8 t70 55.32 23.72 5.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.066 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.52 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 31.0 t -86.29 -26.01 25.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.84 0.353 . . . . 0.0 110.693 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 125.34 -109.36 1.18 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.485 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.4 ' HD1' ' NE1' ' A' ' 44' ' ' TRP . 0.1 OUTLIER -56.93 -24.33 51.72 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.253 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.639 HG12 ' HG ' ' A' ' 61' ' ' LEU . 39.9 t -68.59 -36.53 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.798 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.511 HH21 ' HB2' ' A' ' 65' ' ' ASP . 19.5 ttm180 -78.45 -51.17 10.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.726 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.1 m -58.02 -37.7 74.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.078 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.09 -51.34 50.87 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.224 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.666 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -67.34 -34.02 76.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.934 0.397 . . . . 0.0 110.703 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.528 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -55.48 -61.58 2.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.952 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -57.17 -27.71 62.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.019 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.425 ' O ' HG13 ' A' ' 80' ' ' ILE . 49.0 m -61.63 -29.92 70.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.76 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.567 HD11 HD11 ' A' ' 62' ' ' LEU . 8.3 mp -55.57 -61.34 2.41 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.711 0.291 . . . . 0.0 111.517 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.43 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 6.1 pt-20 -61.31 -24.99 66.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.997 0.427 . . . . 0.0 110.558 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -70.67 -23.95 62.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.234 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.66 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 91.6 mt -81.83 -60.38 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.571 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . 174.93 -130.94 1.85 Allowed Glycine 0 C--N 1.334 0.433 0 C-N-CA 119.962 -1.113 . . . . 0.0 113.805 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.473 ' H ' ' HD2' ' A' ' 84' ' ' ARG . . . -140.89 -72.89 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.768 -0.729 . . . . 0.0 113.623 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -60.9 -25.5 66.78 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.596 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -86.2 -50.71 6.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.675 0.274 . . . . 0.0 111.038 -179.361 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.538 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -70.84 -20.86 22.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.474 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 68.5 ttt180 -49.57 -30.4 8.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.522 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.42 -32.23 54.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.144 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.14 -51.48 37.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.941 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.511 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 4.1 ppp? -64.19 -25.68 68.18 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.548 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -70.21 -37.83 75.14 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -69.7 -28.91 66.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.476 179.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.631 HD22 HD13 ' A' ' 62' ' ' LEU . 1.4 tp -87.57 -27.53 22.51 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.961 0.41 . . . . 0.0 110.123 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.17 -30.97 71.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.253 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.466 ' HG3' HG23 ' A' ' 95' ' ' THR . 12.1 pt-20 -80.22 -22.99 41.21 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 121.088 0.47 . . . . 0.0 109.758 179.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.466 HG23 ' HG3' ' A' ' 94' ' ' GLU . 52.3 p -108.9 13.16 24.98 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.491 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.79 113.94 4.41 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 114.957 -1.019 . . . . 0.0 113.028 -179.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 39.4 m -140.31 130.09 24.48 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.474 -0.363 . . . . 0.0 110.868 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.69 -126.65 42.56 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.638 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.404 ' O ' HG23 ' A' ' 103' ' ' VAL . 59.5 t80 -73.52 -34.23 65.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.674 0.273 . . . . 0.0 111.263 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.468 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.63 -33.27 54.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.983 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.491 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 29.7 ttt180 -72.39 -56.07 6.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.365 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -48.72 -22.94 0.88 Allowed 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.182 0.515 . . . . 0.0 110.602 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.44 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 33.0 t -67.07 -55.04 19.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.646 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.541 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -61.97 -57.07 13.11 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.564 HG13 ' H ' ' A' ' 106' ' ' ASN . 5.2 p -59.65 -58.65 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.564 ' H ' HG13 ' A' ' 105' ' ' VAL . 4.8 t30 -56.72 -30.12 63.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.709 0.29 . . . . 0.0 111.31 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.51 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 1.2 t80 -58.96 -35.18 72.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.128 0.489 . . . . 0.0 110.308 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.8 mt -53.05 -14.37 0.6 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.898 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.01 6.23 11.95 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.7 p -121.59 -63.49 1.31 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.667 0.27 . . . . 0.0 111.506 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 23.6 p80 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 117.946 -1.026 . . . . 0.0 111.573 -179.784 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.768 0.318 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.87 20.42 8.02 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.158 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.421 ' H ' ' H ' ' A' ' 4' ' ' GLU . 17.4 t70 -165.44 -10.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.728 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.421 ' H ' ' H ' ' A' ' 3' ' ' ASP . 10.5 tp10 -86.04 -52.11 5.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.919 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -99.79 15.53 26.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.9 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -55.15 -23.91 23.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.064 0.459 . . . . 0.0 110.498 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -159.87 138.77 10.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.403 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 62.6 t -127.58 -27.23 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.277 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -143.13 -0.85 1.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 111.176 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.432 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 54.3 ttt180 -95.12 146.94 23.95 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.432 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 13.9 t70 77.81 -38.38 0.26 Allowed 'General case' 0 C--N 1.331 -0.207 0 O-C-N 123.519 0.512 . . . . 0.0 111.196 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.434 HG13 ' O ' ' A' ' 12' ' ' VAL . 7.6 p -53.99 113.03 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-O 121.299 0.571 . . . . 0.0 110.914 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.6 t -171.39 -38.07 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.125 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 24.6 p -148.06 8.28 0.84 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.135 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.48 -1.41 58.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.453 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.485 HD13 ' H ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -46.73 -22.33 0.29 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.004 -179.652 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.485 ' H ' HD13 ' A' ' 16' ' ' LEU . 54.8 m -47.61 -36.51 10.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.849 0.356 . . . . 0.0 110.488 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -176.42 94.84 0.05 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.423 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 4.8 mmt -133.39 -43.51 0.85 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.312 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 140.77 -118.24 1.37 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.403 -0.904 . . . . 0.0 112.994 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -101.82 -23.98 14.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.636 0.255 . . . . 0.0 111.341 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.479 ' HG3' ' N ' ' A' ' 23' ' ' ALA . 10.0 pt-20 -63.3 -42.31 99.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.191 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.479 ' N ' ' HG3' ' A' ' 22' ' ' GLU . . . -97.54 15.4 23.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.415 -179.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.452 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 2.3 t80 -63.42 -45.19 92.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.153 0.501 . . . . 0.0 110.817 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.467 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 7.2 mm-40 -63.41 -56.04 30.34 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.536 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.2 Cg_endo -55.6 -14.52 10.26 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 121.712 1.608 . . . . 0.0 110.643 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.561 HD21 HG13 ' A' ' 46' ' ' ILE . 1.4 tp -86.47 -40.26 15.48 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.373 -1.285 . . . . 0.0 109.212 178.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.586 HD12 HD12 ' A' ' 31' ' ' LEU . 31.8 tp -75.15 -22.49 58.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.297 179.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -69.0 -29.68 67.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.612 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 63.8 m -65.09 -27.71 68.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.41 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.586 HD12 HD12 ' A' ' 28' ' ' LEU . 40.7 mt -65.78 -11.35 45.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.172 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.0 m -100.68 16.38 25.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.645 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -88.93 145.51 25.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -67.79 -27.77 67.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.866 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -75.84 146.21 40.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.933 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 12.2 p90 -87.38 -32.91 19.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.2 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.95 -32.12 73.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.923 0.392 . . . . 0.0 110.37 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.9 mm -81.32 -41.01 18.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.294 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.456 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 40.9 ttm180 -64.06 -48.34 76.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.58 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -57.95 -49.55 73.83 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.791 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.09 -26.98 12.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.642 0.258 . . . . 0.0 111.46 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' O ' HD11 ' A' ' 27' ' ' LEU . . . -62.82 -56.69 15.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.71 0.29 . . . . 0.0 111.049 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.411 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -65.81 -28.84 69.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.049 0.452 . . . . 0.0 110.777 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.2 m95 -57.01 -39.49 74.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.481 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.8 mt -98.35 -25.73 3.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.772 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.561 HG13 HD21 ' A' ' 27' ' ' LEU . 3.5 tt -57.93 -20.99 15.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.361 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.86 -27.56 64.49 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.692 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.548 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.9 OUTLIER -60.29 -30.46 69.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.715 0.293 . . . . 0.0 111.018 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -104.69 106.01 16.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.555 ' HG2' HG23 ' A' ' 80' ' ' ILE . 2.5 mt-30 -66.93 80.0 0.12 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.08 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -128.18 156.72 42.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.006 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.41 -28.58 69.35 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.927 0.394 . . . . 0.0 110.989 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -69.31 -9.52 53.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.757 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.471 ' HB2' HG12 ' A' ' 46' ' ' ILE . . . -104.85 15.4 27.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.62 -179.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 56.5 t -91.55 -58.1 3.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.118 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.485 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 17.5 tt0 -56.49 -48.87 96.29 Favored Pre-proline 0 CA--C 1.531 0.216 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.527 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 86.0 Cg_exo -42.12 -48.1 6.54 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.396 2.064 . . . . 0.0 112.527 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.61 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 7.5 mt -62.13 -44.7 96.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.065 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 50.0 mm -53.66 -58.89 2.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.192 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.46 ' HZ1' ' HB3' ' A' ' 31' ' ' LEU . 3.7 pttt -70.16 -18.93 63.22 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.717 ' HG ' HG12 ' A' ' 69' ' ' VAL . 2.9 tp -89.52 -32.71 17.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.746 HD13 HD11 ' A' ' 92' ' ' LEU . 14.2 mt -64.82 -10.49 28.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.127 0.489 . . . . 0.0 110.381 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -114.26 -2.18 13.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.113 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -61.21 -30.23 70.3 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.134 0.493 . . . . 0.0 111.055 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 54.39 27.15 7.77 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.913 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.504 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.4 t -85.0 -19.36 32.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.943 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 119.86 -110.25 1.78 Allowed Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.48 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -56.92 -26.28 58.95 Favored 'General case' 0 CA--C 1.521 -0.155 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.717 HG12 ' HG ' ' A' ' 61' ' ' LEU . 15.5 t -68.24 -34.11 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.879 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.401 ' NH1' ' HA3' ' A' ' 98' ' ' GLY . 60.1 ttp180 -78.44 -40.85 34.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.838 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 97.3 p -67.03 -38.88 86.7 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.478 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.459 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -53.33 -55.23 25.61 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.6 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.61 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -55.72 -32.72 63.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.786 0.327 . . . . 0.0 111.457 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.432 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.78 -63.89 1.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.581 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 72' ' ' GLY . 0.3 OUTLIER -53.62 -32.64 52.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.341 -179.843 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.457 ' HA ' HE21 ' A' ' 79' ' ' GLN . 17.9 t -56.2 -40.28 73.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 110.865 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.618 HD11 HD11 ' A' ' 62' ' ' LEU . 20.0 mt -62.76 -58.52 7.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -50.4 -35.62 29.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.732 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.457 HE21 ' HA ' ' A' ' 76' ' ' SER . 46.3 mt-30 -62.67 -37.35 86.08 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.068 0.461 . . . . 0.0 110.148 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.555 HG23 ' HG2' ' A' ' 50' ' ' GLN . 95.1 mt -72.8 -60.27 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.792 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 59.49 98.88 0.01 OUTLIER Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.803 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.534 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 172.99 -169.73 42.88 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.617 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -72.03 -30.27 65.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.93 0.395 . . . . 0.0 110.777 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.573 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.1 OUTLIER -59.51 -50.47 73.77 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.004 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.564 HG12 HD23 ' A' ' 77' ' ' LEU . 16.5 m -70.74 -25.35 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.002 0.429 . . . . 0.0 110.739 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.439 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -55.77 -27.92 53.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.466 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.22 -34.64 32.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.755 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.08 -49.47 76.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.891 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.596 ' HE2' ' HA ' ' A' ' 104' ' ' ALA . 3.2 mmm -60.17 -46.79 88.5 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -53.3 -32.56 49.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.071 178.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -73.67 -31.37 63.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.848 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.746 HD11 HD13 ' A' ' 62' ' ' LEU . 25.6 mt -76.53 -38.65 54.76 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.85 0.357 . . . . 0.0 110.606 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.456 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -53.21 -32.45 48.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.068 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -84.82 -19.98 31.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.695 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.8 p -122.41 38.37 4.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.55 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -41.94 117.36 1.26 Allowed Glycine 0 C--N 1.334 0.434 0 CA-C-N 115.741 -0.663 . . . . 0.0 113.353 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.4 t -157.45 136.31 11.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.822 0.344 . . . . 0.0 111.091 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.401 ' HA3' ' NH1' ' A' ' 70' ' ' ARG . . . 60.16 -144.96 46.79 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.417 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -91.81 -14.55 29.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.792 0.33 . . . . 0.0 110.457 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -53.99 -35.64 62.08 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.231 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.456 ' NE ' ' HA ' ' A' ' 93' ' ' ALA . 13.9 tpt180 -67.53 -55.8 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.095 179.078 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -48.53 -28.11 3.16 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.727 178.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.2 t -78.03 -44.51 27.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.805 -1.088 . . . . 0.0 111.343 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.596 ' HA ' ' HE2' ' A' ' 89' ' ' MET . . . -54.89 -57.92 9.68 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -178.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.439 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 42.2 t -61.06 -58.59 6.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.326 -178.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -56.51 -42.8 78.98 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.466 ' OH ' HG21 ' A' ' 85' ' ' VAL . 43.1 t80 -62.03 -28.33 69.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.811 0.339 . . . . 0.0 111.606 -178.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 46.5 mt -58.08 -11.87 2.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.627 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -80.21 4.97 15.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.75 0.309 . . . . 0.0 111.07 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.2 p -140.64 -69.97 0.39 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.207 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.007 -0.996 . . . . 0.0 111.567 179.876 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.7 mtt . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.717 0.294 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.15 -15.56 1.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.183 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -110.07 -41.82 4.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.954 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -79.34 179.96 7.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.982 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.4 p30 40.07 84.58 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.025 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -165.94 -38.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.403 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.542 ' HA ' ' HE ' ' A' ' 10' ' ' ARG . 46.0 p-90 -82.81 11.58 5.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.544 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.45 ' O ' ' HB3' ' A' ' 9' ' ' ARG . 5.7 p -53.99 128.79 14.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.4 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 8' ' ' VAL . 23.7 tpt180 73.49 -41.35 0.49 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.009 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.542 ' HE ' ' HA ' ' A' ' 7' ' ' TRP . 65.3 mtm180 -56.55 127.95 33.8 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.445 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 14.6 t70 78.46 -53.72 0.48 Allowed 'General case' 0 N--CA 1.465 0.309 0 O-C-N 123.695 0.622 . . . . 0.0 111.176 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -64.73 175.96 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.624 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.4 t -156.95 -32.92 0.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.787 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.1 p -53.06 154.64 2.88 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.735 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.07 -69.37 0.72 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.516 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.3 pt? -88.43 -38.51 14.98 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.427 ' H ' HD23 ' A' ' 16' ' ' LEU . 47.3 m -53.79 -52.47 60.15 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 -178.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -144.34 105.44 4.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.931 0.396 . . . . 0.0 110.502 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.903 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -133.41 -43.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.651 -179.202 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.21 -93.84 0.87 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.651 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -128.87 2.7 5.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.666 0.27 . . . . 0.0 111.191 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -82.55 -44.71 15.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.911 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.903 ' HB3' ' HG2' ' A' ' 19' ' ' MET . . . -106.59 14.32 27.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.115 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.567 ' HA ' ' HE1' ' A' ' 19' ' ' MET . 1.0 OUTLIER -50.07 -49.78 50.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.315 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.27 -52.55 60.57 Favored Pre-proline 0 N--CA 1.466 0.374 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.822 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.494 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 71.6 Cg_exo -35.03 -34.75 0.1 Allowed 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 122.453 2.102 . . . . 0.0 112.172 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.448 HD13 ' O ' ' A' ' 23' ' ' ALA . 8.4 mp -73.79 -55.3 6.4 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.01 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -50.36 -37.46 37.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.52 178.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -66.62 -32.62 74.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.86 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.7 m -64.92 -13.75 57.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.117 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.471 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 87.7 mt -68.72 -19.81 64.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.897 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 56.7 m -93.36 7.64 43.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.92 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -79.92 128.1 33.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.669 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -58.88 -23.51 61.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.613 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -75.85 149.19 37.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.778 0.323 . . . . 0.0 110.565 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 38.4 p-90 -94.43 -37.95 11.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.442 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -63.69 -42.27 98.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.788 0.328 . . . . 0.0 111.036 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.6 mt -67.56 -44.61 86.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.867 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.471 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.4 ttm180 -63.31 -23.48 67.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.576 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.33 -61.0 6.07 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.48 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.14 -36.31 8.31 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.733 0.301 . . . . 0.0 111.402 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.418 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.56 -54.71 39.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.906 0.384 . . . . 0.0 110.861 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.4 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -64.8 -30.5 71.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.327 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.3 m95 -70.8 -31.2 67.88 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 61.7 mt -99.6 -27.02 3.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.873 0.368 . . . . 0.0 111.648 -178.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.683 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.1 tt -60.85 -28.88 44.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.699 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.543 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -69.89 -4.06 46.13 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.937 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.498 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.9 OUTLIER -69.82 -40.22 76.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.755 0.312 . . . . 0.0 110.196 179.346 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.465 ' C ' ' H ' ' A' ' 51' ' ' ASP . 11.9 m-85 -91.33 119.42 31.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.738 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.459 ' HA ' HD12 ' A' ' 80' ' ' ILE . 1.9 mt-30 -72.78 25.85 0.06 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.48 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.465 ' H ' ' C ' ' A' ' 49' ' ' PHE . 29.2 t70 -83.98 155.33 22.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.908 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -59.07 -33.0 70.29 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.329 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -67.63 -11.96 59.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.865 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.641 ' O ' HD13 ' A' ' 58' ' ' LEU . . . -105.91 -8.45 17.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.036 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 59' ' ' ILE . 96.4 t -91.52 -30.16 4.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.418 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.557 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 17.3 tt0 -60.27 -50.52 85.57 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.683 ' HG2' HD13 ' A' ' 46' ' ' ILE . 74.5 Cg_exo -49.32 -52.37 8.91 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.924 1.75 . . . . 0.0 111.859 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.687 HD23 ' HG ' ' A' ' 77' ' ' LEU . 5.1 mp -56.04 -27.17 52.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.881 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 55' ' ' VAL . 40.4 mm -63.35 -59.54 4.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.739 0.304 . . . . 0.0 111.379 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -70.04 -22.79 63.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.521 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.747 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -65.37 -51.94 57.04 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.941 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.772 HD13 HD22 ' A' ' 92' ' ' LEU . 9.1 mt -51.93 -21.58 3.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.351 . . . . 0.0 111.304 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -104.24 -18.36 14.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.107 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.414 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 8.3 t0 -59.65 -36.06 75.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 111.144 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.482 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 24.7 t70 52.19 30.28 7.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.229 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.488 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.3 t -80.07 -3.07 47.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.217 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.87 -81.56 1.6 Allowed Glycine 0 C--O 1.228 -0.238 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.944 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.64 -47.15 82.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.2 0.524 . . . . 0.0 109.649 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.747 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.2 t -69.04 -45.44 80.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.46 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.482 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 7.0 tmm_? -64.32 -62.45 1.6 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.873 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.7 m -54.07 -30.14 47.01 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.975 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.72 -39.85 94.13 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.41 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.403 ' HA ' ' HG ' ' A' ' 58' ' ' LEU . . . -67.9 -38.85 83.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.638 0.256 . . . . 0.0 111.363 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.63 -54.23 24.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.3 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.436 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 4.0 ptp180 -67.96 -42.94 80.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.002 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.543 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 74.6 m -59.21 -31.06 68.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.742 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.695 HD22 HG13 ' A' ' 85' ' ' VAL . 69.6 mt -70.67 -60.46 2.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.975 -179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -59.87 -22.51 62.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.147 0.499 . . . . 0.0 110.293 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.436 ' HB2' ' O ' ' A' ' 75' ' ' ARG . 7.6 tt0 -56.9 -37.49 71.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.56 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.459 HD12 ' HA ' ' A' ' 50' ' ' GLN . 32.2 mm -71.56 -60.22 2.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.963 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.44 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 69.45 80.31 0.26 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.296 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -176.69 179.1 47.85 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.391 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -63.44 -22.39 66.86 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.823 0.345 . . . . 0.0 110.971 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.56 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -62.07 -59.88 4.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.355 -179.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.695 HG13 HD22 ' A' ' 77' ' ' LEU . 74.8 t -69.64 -24.09 26.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.94 0.4 . . . . 0.0 110.638 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.427 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 2.7 tmt_? -56.65 -27.44 58.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.072 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -82.67 -31.8 28.46 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.769 0.319 . . . . 0.0 111.079 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.79 -34.51 75.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.422 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.57 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 7.0 mmt -71.17 -47.57 56.91 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.414 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -57.74 -29.85 65.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.031 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -80.07 -32.7 39.29 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.935 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.772 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -80.81 -26.08 37.37 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.022 0.439 . . . . 0.0 109.847 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.02 -21.67 65.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.526 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -80.22 -27.21 38.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.675 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.1 p -118.44 24.27 11.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.387 178.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.43 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -56.85 119.65 16.59 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.185 -0.916 . . . . 0.0 113.549 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.4 t -144.58 130.4 19.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.836 0.351 . . . . 0.0 110.894 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.44 -130.08 11.84 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.824 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -87.0 -26.51 23.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.571 0.225 . . . . 0.0 111.267 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.652 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.42 -37.49 62.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.859 0.362 . . . . 0.0 111.5 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.43 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 35.4 ttp180 -66.56 -58.46 5.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.707 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 57.9 tttp -46.23 -24.31 0.45 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.191 0.52 . . . . 0.0 110.79 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 45.2 t -71.93 -59.74 3.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.634 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.738 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -56.34 -51.79 66.95 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 15.5 t -62.27 -63.74 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -55.36 -39.3 69.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.57 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 31.0 t80 -61.57 -31.73 71.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 120.808 0.337 . . . . 0.0 111.441 -178.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 58.5 mt -57.38 -12.19 2.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.61 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.86 -12.2 60.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.865 0.364 . . . . 0.0 110.993 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 73.0 p -113.7 -62.62 1.57 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.309 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.152 -0.927 . . . . 0.0 110.805 -179.971 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.752 0.311 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 62.42 14.47 6.94 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.305 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -111.54 -49.22 3.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.823 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -89.4 -40.46 12.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.985 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -80.21 99.51 7.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.101 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HG3' HH21 ' A' ' 10' ' ' ARG . 61.4 tttm -173.43 -46.47 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.67 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.3 p-90 -97.0 11.96 34.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.87 -38.16 79.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.023 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 74.2 mtt180 -110.92 -65.68 1.15 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.589 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.535 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 80.2 mtm180 -52.96 152.72 3.82 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.535 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 6.4 m-20 78.1 -38.6 0.25 Allowed 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.522 0.514 . . . . 0.0 111.758 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 52.4 t -68.9 -76.9 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.548 0.213 . . . . 0.0 111.319 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.2 t -169.57 178.04 4.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.974 0.416 . . . . 0.0 111.282 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.561 ' HB ' ' HA ' ' A' ' 18' ' ' ARG . 47.7 p -126.88 119.57 27.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.481 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.95 ' HB3' ' HB3' ' A' ' 23' ' ' ALA . . . -95.67 -73.94 0.57 Allowed 'General case' 0 C--O 1.231 0.13 0 C-N-CA 120.203 -0.599 . . . . 0.0 112.203 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.5 tp -91.28 -69.71 0.72 Allowed 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.398 -0.521 . . . . 0.0 111.347 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 59.3 p -92.66 -52.91 4.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.01 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.561 ' HA ' ' HB ' ' A' ' 14' ' ' THR . 32.4 ttm180 175.9 28.32 0.0 OUTLIER 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.185 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.587 ' HB3' ' HB3' ' A' ' 22' ' ' GLU . 1.5 mtp -89.62 -44.23 10.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.101 -178.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.728 ' H ' ' H ' ' A' ' 15' ' ' ALA . . . 83.95 -85.88 1.53 Allowed Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.555 -0.831 . . . . 0.0 113.096 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.76 2.31 55.5 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.587 ' HB3' ' HB3' ' A' ' 19' ' ' MET . 9.9 tp10 -106.55 -22.91 12.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.82 0.343 . . . . 0.0 110.935 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.95 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . . . -96.63 3.12 52.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.181 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.4 t80 -60.61 -48.59 81.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.969 0.414 . . . . 0.0 110.243 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.406 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 18.9 mt-10 -63.45 -56.99 22.03 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.965 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.509 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 88.0 Cg_exo -43.04 -28.82 1.38 Allowed 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.365 2.043 . . . . 0.0 111.624 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 65.3 mt -68.76 -55.02 12.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.298 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.554 HD12 HD12 ' A' ' 31' ' ' LEU . 18.7 tp -67.88 -18.82 64.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.513 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -79.04 -42.8 25.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.964 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.1 p -66.48 -13.7 61.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.395 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.554 HD12 HD12 ' A' ' 28' ' ' LEU . 87.3 mt -67.51 -7.4 25.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.244 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.8 p -95.7 15.33 20.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.561 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -95.01 136.93 34.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.851 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -67.3 -1.87 5.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.025 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -84.59 153.24 23.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.77 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.4 p-90 -104.43 -38.64 6.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.954 0.407 . . . . 0.0 110.53 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.454 ' HG3' HG13 ' A' ' 38' ' ' ILE . 13.7 ptm180 -62.82 -39.03 93.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.79 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.454 HG13 ' HG3' ' A' ' 37' ' ' ARG . 50.8 mt -79.36 -47.99 21.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.934 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.488 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 38.3 ttm180 -63.5 -28.51 70.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.601 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.69 -59.02 6.37 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.423 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.14 -29.63 22.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.741 0.305 . . . . 0.0 110.976 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.67 -55.49 23.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.479 ' O ' HG22 ' A' ' 46' ' ' ILE . . . -69.48 -22.89 63.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.193 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.1 m95 -66.12 -28.31 68.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.614 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.8 mt -99.6 -23.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.71 179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.479 HG22 ' O ' ' A' ' 43' ' ' ALA . 0.6 OUTLIER -61.08 -32.69 53.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.503 -179.248 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.62 -16.58 63.52 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.552 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.556 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.9 OUTLIER -68.97 -27.04 65.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.837 0.351 . . . . 0.0 110.681 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -99.05 112.77 24.81 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.801 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.745 ' H ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -77.98 36.58 0.23 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.817 179.473 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.416 ' O ' HG23 ' A' ' 55' ' ' VAL . 33.9 t70 -95.37 165.53 12.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.992 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.48 -31.31 72.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.518 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.444 ' HB3' ' CE2' ' A' ' 24' ' ' PHE . 41.5 ttm180 -69.17 -14.15 62.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.425 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.37 5.19 31.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.031 0.444 . . . . 0.0 110.641 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.651 ' HA ' ' NH2' ' A' ' 84' ' ' ARG . 98.9 t -87.03 -46.9 16.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.804 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.466 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 34.2 tt0 -60.34 -48.25 94.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.466 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 81.0 Cg_exo -42.14 -52.09 4.36 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.405 2.07 . . . . 0.0 112.817 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 73' ' ' ALA . 6.8 mt -60.62 -37.0 79.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.333 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 47.9 mm -55.21 -59.43 2.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.477 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.19 -15.77 62.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.24 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.788 HD23 ' H ' ' A' ' 73' ' ' ALA . 0.4 OUTLIER -74.14 -52.66 11.85 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -178.892 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.52 HD13 HD22 ' A' ' 92' ' ' LEU . 7.9 mt -57.06 -10.34 1.12 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.306 -179.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -111.99 -13.44 13.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.618 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.413 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 52.8 m-20 -61.14 -32.23 71.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.799 0.333 . . . . 0.0 111.78 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.511 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 32.9 m-20 48.26 32.12 2.98 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.07 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.47 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 29.3 t -83.07 -24.42 32.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.494 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.43 -85.39 0.39 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.95 -0.643 . . . . 0.0 111.556 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.89 -42.43 99.77 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.679 HG12 ' HG ' ' A' ' 61' ' ' LEU . 13.6 t -69.33 -56.86 10.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.056 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.511 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 7.3 tmm_? -54.67 -51.65 64.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.544 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.6 m -63.96 -19.92 65.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.377 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.49 -65.12 3.65 Favored Glycine 0 C--O 1.228 -0.222 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.572 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.788 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -49.77 -31.23 11.06 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.63 -46.54 73.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.788 0.328 . . . . 0.0 111.35 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 6.8 ptp180 -82.23 -24.45 34.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.853 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.542 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 49.6 m -63.52 -38.94 93.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.512 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.6 mt -58.92 -59.96 4.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.137 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.458 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 38.8 mt-10 -46.23 -32.67 3.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.132 179.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.542 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 20.6 mt-30 -70.81 -41.5 71.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.348 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.499 HD13 ' HE ' ' A' ' 84' ' ' ARG . 59.9 mt -75.28 -61.43 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.86 -179.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.64 168.51 2.36 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.673 -0.775 . . . . 0.0 113.006 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.58 -170.59 24.4 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.895 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -64.89 -24.48 67.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.156 0.503 . . . . 0.0 110.419 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.651 ' NH2' ' HA ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER -54.83 -62.37 1.7 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.63 179.719 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.528 HG21 ' OH ' ' A' ' 107' ' ' TYR . 16.1 m -63.22 -24.75 36.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.27 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.534 ' HA ' ' HE1' ' A' ' 89' ' ' MET . 0.2 OUTLIER -54.62 -33.36 60.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.366 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.21 -24.27 24.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.713 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.43 ' HB2' ' NH1' ' A' ' 84' ' ' ARG . . . -70.27 -49.06 53.72 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.534 ' HE1' ' HA ' ' A' ' 86' ' ' ARG . 0.7 OUTLIER -70.18 -30.51 67.65 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.639 0.257 . . . . 0.0 110.888 -179.14 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -69.8 -43.4 72.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.7 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -67.91 -28.99 67.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.716 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.52 HD22 HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -86.33 -27.84 24.06 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.999 179.702 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.9 -22.91 65.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.578 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -80.23 -26.67 38.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.494 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 59.8 p -122.65 23.58 9.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.374 0.606 . . . . 0.0 109.471 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.559 ' HA3' ' HG2' ' A' ' 101' ' ' ARG . . . -58.31 124.94 38.02 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 115.036 -0.984 . . . . 0.0 113.128 -179.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.412 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 2.3 t -141.23 130.15 23.13 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.72 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 62.63 -140.18 45.85 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.406 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.483 ' O ' HG23 ' A' ' 103' ' ' VAL . 62.2 t80 -62.07 -35.5 78.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.758 0.313 . . . . 0.0 110.66 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.504 ' HB2' ' HD3' ' A' ' 70' ' ' ARG . . . -54.44 -36.53 64.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.253 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.559 ' HG2' ' HA3' ' A' ' 96' ' ' GLY . 1.3 tmt_? -68.83 -61.78 1.66 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.466 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -52.11 -22.53 4.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.295 -179.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 99' ' ' PHE . 5.1 t -67.07 -53.15 36.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.536 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.453 ' O ' HD23 ' A' ' 108' ' ' LEU . . . -54.81 -62.61 1.54 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.068 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.5 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 23.5 t -54.78 -57.67 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.397 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.14 -32.5 66.43 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.528 ' OH ' HG21 ' A' ' 85' ' ' VAL . 34.9 t80 -63.3 -25.35 68.27 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 120.759 0.314 . . . . 0.0 111.161 -178.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.8 mm? -50.91 -26.89 6.46 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.01 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -53.91 -13.58 0.79 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.36 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 34.7 p -119.75 -87.49 0.64 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.305 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.418 ' HB2' HG21 ' A' ' 85' ' ' VAL . 15.7 m-70 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.952 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.0 mmt . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.78 0.324 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.72 -36.72 18.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.372 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -75.6 167.69 21.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.139 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -90.1 51.63 2.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.086 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.6 p30 41.53 84.32 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.779 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -128.13 -18.9 4.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.577 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -117.08 51.36 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.835 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.443 ' O ' HG21 ' A' ' 12' ' ' VAL . 8.8 p -166.98 -24.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.409 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -119.45 -30.42 4.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.919 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.475 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 46.3 ttt180 -59.82 135.05 57.57 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.475 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 20.6 t70 75.03 -20.9 0.32 Allowed 'General case' 0 N--CA 1.465 0.302 0 O-C-N 123.399 0.437 . . . . 0.0 111.544 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.482 HG13 ' HA ' ' A' ' 19' ' ' MET . 74.1 t -66.16 -73.16 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.342 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.8 t 62.9 -83.09 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.023 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.6 p -59.64 169.64 1.29 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.805 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.417 ' O ' ' HB3' ' A' ' 19' ' ' MET . . . -95.88 -69.83 0.74 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.525 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.2 pt? -87.68 -26.6 22.9 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.7 t -59.05 -51.85 68.27 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.949 0.404 . . . . 0.0 110.504 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.624 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 3.2 mmp_? -148.21 112.98 5.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.987 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.641 ' HB2' ' HB3' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -133.46 -44.41 0.83 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.797 -178.961 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.49 ' N ' ' HG2' ' A' ' 19' ' ' MET . . . 62.6 84.66 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.909 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.491 ' H ' ' HE2' ' A' ' 49' ' ' PHE . 19.0 t70 67.43 9.02 6.71 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.641 ' HB3' ' HB2' ' A' ' 19' ' ' MET . 12.6 tp10 -103.98 -45.09 4.85 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.186 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.573 ' HB3' ' HG3' ' A' ' 19' ' ' MET . . . -107.02 17.86 22.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.895 0.378 . . . . 0.0 110.91 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 51' ' ' ASP . 0.4 OUTLIER -52.62 -48.27 66.47 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.021 179.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.526 ' HG3' ' NH1' ' A' ' 53' ' ' ARG . 3.6 mt-10 -62.21 -57.02 25.68 Favored Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 1.9 Cg_endo -50.72 -19.18 4.85 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.996 1.797 . . . . 0.0 111.498 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.505 HD21 ' HA ' ' A' ' 46' ' ' ILE . 0.8 OUTLIER -81.63 -39.91 23.72 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.697 179.367 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 31' ' ' LEU . 10.8 tp -80.26 -22.15 41.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.364 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -73.95 -34.63 64.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.626 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.0 m -66.17 -17.19 64.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.12 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.624 HD12 HD12 ' A' ' 28' ' ' LEU . 51.3 mt -68.23 -6.59 24.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.862 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.1 m -103.19 11.24 37.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.758 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -71.1 142.15 50.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.821 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -59.51 -34.53 72.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.346 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -81.4 144.33 31.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.973 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.1 p90 -87.3 -32.8 19.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.016 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -58.77 -35.62 73.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.468 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.2 mm -80.83 -41.4 19.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.492 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.531 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 29.5 ttm180 -63.26 -20.02 65.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.629 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.81 -62.88 3.58 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.707 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.62 -33.04 2.64 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.644 0.259 . . . . 0.0 111.438 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.438 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.02 -52.75 63.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.916 0.389 . . . . 0.0 110.085 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.496 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -64.47 -28.71 69.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.74 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -66.97 -36.69 82.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.124 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.1 mm -99.29 -22.29 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.505 ' HA ' HD21 ' A' ' 27' ' ' LEU . 4.2 tt -61.04 -38.94 80.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -178.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.75 -6.59 17.87 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.256 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.595 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER -70.59 -49.77 44.22 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.514 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.491 ' HE2' ' H ' ' A' ' 21' ' ' ASP . 41.3 m-85 -65.69 -26.81 67.94 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.508 ' HG2' HG12 ' A' ' 80' ' ' ILE . 2.0 mt-30 61.07 16.29 6.97 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.783 0.325 . . . . 0.0 111.4 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 55' ' ' VAL . 18.9 t70 -84.11 -178.72 7.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.033 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -61.54 -37.24 83.06 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -179.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.609 ' HB3' HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -67.19 -10.6 52.14 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.888 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.98 -9.42 17.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.975 0.417 . . . . 0.0 111.273 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 51' ' ' ASP . 62.5 t -82.02 -47.88 18.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.934 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.481 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 4.7 tp10 -60.1 -48.31 94.76 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.5 ' HG2' HD13 ' A' ' 46' ' ' ILE . 83.9 Cg_exo -43.0 -53.07 4.26 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.289 1.993 . . . . 0.0 112.664 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.613 HD13 HD22 ' A' ' 77' ' ' LEU . 16.3 mt -53.54 -34.22 57.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.046 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 42.9 mm -63.29 -61.15 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.503 ' HG3' HD13 ' A' ' 61' ' ' LEU . 16.8 pttt -72.19 -19.09 61.8 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.675 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -77.77 -51.1 11.07 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.617 HD11 HD21 ' A' ' 77' ' ' LEU . 69.4 mt -63.43 -9.01 10.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.225 0.536 . . . . 0.0 109.972 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -112.94 -16.23 12.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.478 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.459 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.9 OUTLIER -61.09 -54.44 44.61 Favored 'General case' 0 CA--C 1.517 -0.288 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.307 -179.571 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 12.5 t70 72.02 25.5 3.02 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.738 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 69.0 m -81.21 -4.92 57.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.993 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.53 -101.84 2.45 Favored Glycine 0 C--O 1.229 -0.193 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.656 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.16 -30.46 37.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.262 0.553 . . . . 0.0 109.928 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.675 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.0 t -73.6 -46.83 46.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.198 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -70.46 -60.51 2.22 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.686 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.6 m -54.16 -28.34 39.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.872 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.88 -37.74 94.85 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.447 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.421 ' O ' HD23 ' A' ' 77' ' ' LEU . . . -79.8 -37.08 36.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.653 0.263 . . . . 0.0 110.987 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -46.26 -35.06 4.89 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.157 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.416 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 1.2 ptp85 -83.91 -33.51 24.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.652 0.263 . . . . 0.0 111.453 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.483 ' HA ' HE21 ' A' ' 79' ' ' GLN . 66.4 m -57.84 -37.43 73.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.891 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.617 HD21 HD11 ' A' ' 62' ' ' LEU . 4.1 mm? -55.33 -61.22 2.48 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.859 0.361 . . . . 0.0 110.95 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -65.25 -24.69 67.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.677 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.483 HE21 ' HA ' ' A' ' 76' ' ' SER . 3.2 tt0 -60.89 -58.49 8.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.8 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.607 HD12 HG13 ' A' ' 85' ' ' VAL . 95.4 mt -63.29 -52.02 63.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.101 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 55.39 76.43 0.19 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.663 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -174.68 -179.76 45.48 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.598 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -59.64 -21.48 60.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.951 0.405 . . . . 0.0 110.699 179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.612 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 1.2 mpt_? -59.7 -64.33 0.98 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.333 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.607 HG13 HD12 ' A' ' 80' ' ' ILE . 0.0 OUTLIER -70.84 -20.59 22.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.931 179.351 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -52.88 -33.09 48.42 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.933 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.55 -26.34 35.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.441 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.17 -45.0 64.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.008 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.556 ' HE3' ' HG2' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -68.88 -29.77 68.13 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.488 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.556 ' HG2' ' HE3' ' A' ' 89' ' ' MET . 10.1 mm-40 -70.82 -31.32 68.01 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.077 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -74.45 -31.4 62.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.191 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.56 HD21 ' O ' ' A' ' 100' ' ' ALA . 1.7 tp -86.55 -32.23 20.81 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.776 0.322 . . . . 0.0 110.172 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -54.91 -28.06 47.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.162 0.506 . . . . 0.0 110.265 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -83.21 -25.46 31.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.205 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 54.2 p -116.12 32.08 6.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.008 179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.565 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -46.51 121.41 5.66 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.307 -0.86 . . . . 0.0 113.771 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.0 m -150.47 130.71 13.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.777 0.322 . . . . 0.0 110.403 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.9 -139.72 28.97 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.348 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -89.6 -18.48 26.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.824 0.345 . . . . 0.0 110.367 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.604 ' HB1' ' HB3' ' A' ' 62' ' ' LEU . . . -54.18 -43.96 71.14 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.594 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.565 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 55.4 ttp180 -51.84 -57.95 7.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.31 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -56.55 -32.15 64.86 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.094 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.56 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 18.9 t -64.14 -41.83 93.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.227 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.516 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -64.51 -57.18 9.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.056 0.455 . . . . 0.0 111.872 -179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.523 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 6.3 p -64.93 -54.26 31.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.879 -178.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.516 ' N ' HG13 ' A' ' 105' ' ' VAL . 5.1 t30 -55.55 -34.36 64.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.588 0.232 . . . . 0.0 111.404 -179.123 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.449 ' OH ' HG23 ' A' ' 85' ' ' VAL . 5.6 t80 -58.83 -31.68 68.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.46 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.523 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -49.96 -20.29 0.89 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.53 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -69.08 5.06 1.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.449 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.8 m -108.48 -72.51 0.72 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.711 0.291 . . . . 0.0 111.329 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 84.4 t60 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.735 179.999 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.7 tpt . . . . . 0 N--CA 1.484 1.247 0 CA-C-O 120.851 0.358 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -126.34 26.67 6.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.059 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.7 t70 64.47 9.16 4.79 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.861 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -98.83 -47.92 5.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.729 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -104.86 111.68 24.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.782 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 53.7 mttm -104.32 -43.43 5.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.82 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -97.62 111.84 23.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.4 p -175.94 -24.94 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.282 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -105.56 1.33 27.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.14 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' C ' ' H ' ' A' ' 12' ' ' VAL . 25.4 ptt180 -51.66 105.7 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.48 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.401 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 13.5 t70 74.81 -26.75 0.19 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.26 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.531 HG12 ' HB2' ' A' ' 17' ' ' SER . 7.0 t -68.09 158.92 5.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.021 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.541 ' O ' HG22 ' A' ' 14' ' ' THR . 6.7 t -157.59 -156.44 0.58 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.809 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.614 HG23 ' H ' ' A' ' 16' ' ' LEU . 3.2 t 49.08 -170.55 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.044 -0.525 . . . . 0.0 112.093 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.464 ' O ' ' HG2' ' A' ' 18' ' ' ARG . . . -56.99 -41.25 78.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.979 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.614 ' H ' HG23 ' A' ' 14' ' ' THR . 2.7 tm? -49.57 -28.58 5.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.743 0.306 . . . . 0.0 111.041 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.531 ' HB2' HG12 ' A' ' 12' ' ' VAL . 28.0 t -87.18 -27.73 22.85 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 20.9 ptt180 -52.67 -27.27 16.61 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.567 0.222 . . . . 0.0 111.401 -179.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.733 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 72.1 mmm -121.75 -27.32 4.7 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.905 0.383 . . . . 0.0 110.302 178.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 84.6 -122.49 5.9 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.461 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -66.02 -24.69 66.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.847 0.356 . . . . 0.0 110.484 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -77.82 -13.06 60.01 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.733 ' HB2' ' HB2' ' A' ' 19' ' ' MET . . . -94.83 2.57 55.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.619 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.3 t80 -62.26 -40.43 96.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 121.315 0.578 . . . . 0.0 109.526 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.513 ' HG2' ' NH1' ' A' ' 53' ' ' ARG . 43.2 mt-10 -63.41 -56.2 28.92 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.881 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.586 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 77.2 Cg_exo -37.2 -29.23 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.24 0 C-N-CA 122.639 2.226 . . . . 0.0 111.695 179.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 81.7 mt -72.68 -58.41 3.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.588 178.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.544 ' HA ' HD12 ' A' ' 31' ' ' LEU . 49.1 tp -61.27 -24.88 66.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.783 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -79.1 -44.6 21.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.765 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.5 p -65.54 -11.73 46.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.0 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.547 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 43.5 mt -70.21 -6.84 37.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.129 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 77.7 p -111.98 13.89 20.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.776 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.726 HD21 ' HB2' ' A' ' 35' ' ' ASP . 0.8 OUTLIER -69.09 147.67 51.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.017 179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -56.82 -44.12 81.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.395 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.726 ' HB2' HD21 ' A' ' 33' ' ' ASN . 10.9 m-20 -75.85 163.27 27.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.055 0.455 . . . . 0.0 111.388 -179.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -103.72 -29.59 10.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.737 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -63.53 -32.97 74.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.218 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.3 mt -81.16 -41.8 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.847 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.547 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 32.7 ttm180 -61.75 -29.8 70.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.724 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -56.11 -63.25 5.48 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.348 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.27 -29.28 9.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.545 0.212 . . . . 0.0 111.479 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.56 -52.08 59.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.873 0.368 . . . . 0.0 110.531 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.431 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -67.01 -31.35 71.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.687 179.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -70.7 -28.29 64.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.254 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 81.2 mt -98.76 -27.99 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.841 0.353 . . . . 0.0 111.655 -179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.594 HD13 ' HG2' ' A' ' 57' ' ' PRO . 1.5 tt -60.31 -30.36 46.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.827 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.42 -20.8 63.81 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.939 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -65.79 -23.85 66.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.846 0.355 . . . . 0.0 110.445 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.489 ' C ' ' H ' ' A' ' 51' ' ' ASP . 9.1 m-85 -95.29 109.5 21.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.486 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -71.85 16.66 0.11 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.3 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.489 ' H ' ' C ' ' A' ' 49' ' ' PHE . 37.1 t70 -84.04 161.56 20.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.641 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.91 -28.7 69.13 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.552 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.513 ' NH1' ' HG2' ' A' ' 25' ' ' GLU . 12.7 ttm180 -63.91 -13.95 49.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.024 0.44 . . . . 0.0 110.489 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.19 -10.61 16.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.486 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.429 HG13 ' HB2' ' A' ' 88' ' ' ALA . 68.2 t -82.23 -36.11 13.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.625 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.559 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 3.8 tp10 -60.37 -49.97 87.96 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.274 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.594 ' HG2' HD13 ' A' ' 46' ' ' ILE . 82.8 Cg_exo -45.14 -51.27 7.89 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.287 1.991 . . . . 0.0 111.892 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.754 HD13 HD22 ' A' ' 77' ' ' LEU . 4.8 mt -54.73 -35.04 63.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.624 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.558 HG23 ' HD2' ' A' ' 91' ' ' LYS . 46.2 mm -60.77 -60.76 2.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.822 0.344 . . . . 0.0 111.566 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -71.48 -10.85 60.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 112.103 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.75 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.7 mp -88.62 -48.05 7.83 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.692 HD13 HD22 ' A' ' 92' ' ' LEU . 26.5 mt -60.32 -12.31 8.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.971 0.415 . . . . 0.0 110.798 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -113.93 -11.97 12.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.816 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -61.12 -44.95 96.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.101 0.477 . . . . 0.0 111.089 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.63 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 28.5 m-20 66.93 22.22 10.17 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.944 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.513 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 39.6 m -86.38 16.06 4.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.637 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.08 -100.27 0.84 Allowed Glycine 0 C--O 1.227 -0.319 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.857 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -46.86 -40.97 14.97 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.076 0.465 . . . . 0.0 110.741 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.75 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.4 t -71.26 -51.11 36.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.45 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.63 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 53.7 ttp180 -62.3 -60.64 3.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.22 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 88.5 p -53.98 -34.13 58.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.993 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.48 -26.71 57.31 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.056 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.5 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -88.12 -39.77 14.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.787 0.327 . . . . 0.0 110.878 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.07 -34.99 59.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.099 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -80.66 -23.97 39.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.937 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.676 ' HA ' HE21 ' A' ' 79' ' ' GLN . 74.6 m -67.07 -39.07 86.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.291 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.754 HD22 HD13 ' A' ' 58' ' ' LEU . 4.2 mm? -55.36 -57.02 13.58 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.826 0.345 . . . . 0.0 110.565 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.91 -34.75 78.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.363 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.676 HE21 ' HA ' ' A' ' 76' ' ' SER . 0.2 OUTLIER -56.37 -44.61 80.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.254 -179.713 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.409 HD12 ' CG1' ' A' ' 85' ' ' VAL . 92.2 mt -78.22 -59.73 2.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.853 0.359 . . . . 0.0 110.752 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.61 97.77 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.599 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.437 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 170.16 -177.48 43.44 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.484 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -68.83 -30.97 69.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.572 0.225 . . . . 0.0 110.972 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.538 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.57 -53.22 60.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.821 0.343 . . . . 0.0 110.438 179.732 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.538 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -70.82 -24.07 24.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.267 179.311 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.444 HH11 ' HD2' ' A' ' 86' ' ' ARG . 18.1 ttt180 -58.84 -38.09 77.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.419 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.32 -22.86 59.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.757 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.429 ' HB2' HG13 ' A' ' 55' ' ' VAL . . . -71.52 -46.83 58.54 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.993 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.603 ' HE2' ' HB3' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -72.23 -32.69 66.94 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.6 179.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.534 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 27.1 mt-10 -59.16 -41.46 88.44 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 179.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.558 ' HD2' HG23 ' A' ' 59' ' ' ILE . 9.3 tmtm? -64.49 -23.6 67.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.636 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.692 HD22 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -87.1 -28.37 22.56 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.881 179.223 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.26 -30.97 72.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.317 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.476 ' HG3' HG23 ' A' ' 95' ' ' THR . 13.5 pt-20 -80.15 -18.63 49.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.967 0.413 . . . . 0.0 110.366 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.476 HG23 ' HG3' ' A' ' 94' ' ' GLU . 51.2 p -123.98 25.53 7.9 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -65.89 127.01 30.12 Favored Glycine 0 N--CA 1.443 -0.871 0 CA-C-N 115.011 -0.995 . . . . 0.0 113.343 -178.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.1 t -141.92 131.83 24.44 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.27 -0.465 . . . . 0.0 111.138 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.02 -127.13 42.33 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.821 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -66.46 -40.02 89.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.596 0.236 . . . . 0.0 111.058 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.53 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -50.67 -41.17 55.25 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.605 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.424 ' CD ' ' HA3' ' A' ' 96' ' ' GLY . 7.9 tpt180 -64.33 -59.11 4.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.092 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -50.02 -23.27 1.95 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.146 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.53 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 13.6 t -66.45 -60.27 2.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.587 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.26 -53.23 60.41 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.524 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 10.2 p -60.79 -50.07 82.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -177.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.52 ' N ' HG13 ' A' ' 105' ' ' VAL . 58.1 t30 -70.75 -30.67 67.25 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.439 ' HD2' ' HG2' ' A' ' 89' ' ' MET . 7.4 t80 -64.56 -49.07 72.67 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -177.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.603 ' HB3' ' HE2' ' A' ' 89' ' ' MET . 3.8 pp -55.03 -12.14 0.8 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.238 -178.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -65.87 -30.27 70.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.917 0.389 . . . . 0.0 110.692 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 22.0 p -112.61 -42.24 3.68 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.161 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 29.9 p80 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.529 -0.748 . . . . 0.0 111.488 179.74 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 ptp . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.89 0.376 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.11 -58.3 2.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.124 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -104.76 106.51 17.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.989 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 57.37 -168.22 0.12 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.181 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.577 HD22 ' N ' ' A' ' 5' ' ' ASN . 0.8 OUTLIER -91.39 67.32 5.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.894 -179.782 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.441 ' C ' ' H ' ' A' ' 8' ' ' VAL . 31.6 mmmt -110.19 159.05 17.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.491 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 68.18 -7.49 0.65 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.862 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.586 ' HB ' ' HG3' ' A' ' 22' ' ' GLU . 1.5 m -47.87 -52.7 6.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.663 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.559 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 38.5 ptt180 -172.21 3.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.262 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.491 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 59.5 mtp180 -62.22 104.83 0.52 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.491 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 6.1 m-20 69.96 4.18 4.67 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.369 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.559 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 19.2 t -89.22 -68.3 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.259 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.8 m 63.53 160.81 0.1 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.092 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 81.9 p 47.39 34.28 3.21 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.007 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 19' ' ' MET . . . -82.58 -2.02 52.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.599 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.439 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.3 pt? -49.49 -18.82 0.46 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.55 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 38.4 t -68.01 -50.89 52.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.889 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -139.78 72.39 1.4 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.479 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.51 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -134.16 -43.78 0.79 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.931 0.396 . . . . 0.0 110.552 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.77 -77.15 1.65 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.27 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -68.5 -69.44 0.33 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -178.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.586 ' HG3' ' HB ' ' A' ' 8' ' ' VAL . 11.6 mm-40 -62.04 -6.49 2.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.899 0.38 . . . . 0.0 110.65 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.704 ' O ' HD23 ' A' ' 27' ' ' LEU . . . -97.95 -23.17 15.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.392 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.507 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 5.6 t80 -41.96 -55.91 2.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.42 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.41 -58.77 14.11 Favored Pre-proline 0 C--N 1.324 -0.507 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.485 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.553 ' HA ' ' HB2' ' A' ' 29' ' ' GLU . 66.9 Cg_exo -40.51 -36.5 1.78 Allowed 'Trans proline' 0 C--N 1.361 1.217 0 C-N-CA 122.622 2.214 . . . . 0.0 112.462 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.704 HD23 ' O ' ' A' ' 23' ' ' ALA . 3.8 mm? -53.03 -57.06 11.66 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.115 0.483 . . . . 0.0 110.282 178.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.497 HD12 HD12 ' A' ' 31' ' ' LEU . 1.1 tp -74.3 -31.51 62.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.693 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 26' ' ' PRO . 43.2 mt-10 -64.53 -29.77 70.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.584 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.0 t -66.38 -17.35 64.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.226 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.497 HD12 HD12 ' A' ' 28' ' ' LEU . 86.9 mt -67.53 -6.38 19.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.804 0.335 . . . . 0.0 110.741 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.4 p -121.95 21.52 10.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -86.02 149.07 25.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.892 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.65 -31.75 73.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.368 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -82.54 163.3 21.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.734 0.302 . . . . 0.0 110.918 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -110.89 -41.75 4.17 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.476 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -58.9 -29.44 67.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.05 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.14 -42.86 27.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.718 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.465 ' HD2' HG21 ' A' ' 69' ' ' VAL . 33.7 ttm180 -61.99 -20.45 63.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.305 179.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.89 -66.26 2.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.282 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.69 -28.27 5.77 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.693 0.282 . . . . 0.0 111.216 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.515 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -62.57 -56.99 12.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.498 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.68 -31.54 72.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.785 179.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -70.87 -34.31 71.49 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.784 -178.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.4 mt -99.24 -21.22 5.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.851 0.358 . . . . 0.0 111.852 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.536 HD13 ' HG2' ' A' ' 57' ' ' PRO . 7.0 tt -61.06 -33.41 55.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -69.51 -22.46 76.53 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.663 -0.78 . . . . 0.0 113.152 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -70.81 -10.95 60.58 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -84.57 -34.82 23.13 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.696 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.3 OUTLIER 59.74 47.09 10.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.977 0.418 . . . . 0.0 110.952 -179.67 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.482 ' O ' HG23 ' A' ' 55' ' ' VAL . 10.8 t70 -127.5 178.84 5.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.19 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -60.81 -43.89 97.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.99 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.445 HH11 HD23 ' A' ' 28' ' ' LEU . 15.6 mmt180 -64.47 -10.81 27.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.724 0.297 . . . . 0.0 111.224 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.23 5.47 32.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.642 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 51' ' ' ASP . 94.6 t -90.7 -55.65 6.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.123 -179.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.469 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 31.9 tt0 -57.64 -48.87 96.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.536 ' HG2' HD13 ' A' ' 46' ' ' ILE . 80.2 Cg_exo -42.64 -53.3 3.91 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.379 2.053 . . . . 0.0 112.619 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.547 HD13 HD22 ' A' ' 77' ' ' LEU . 12.3 mt -54.27 -38.77 66.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.71 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 51.0 mm -60.71 -60.2 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -70.1 -7.78 44.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.89 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.764 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.0 OUTLIER -89.49 -42.85 11.23 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.507 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.602 HD13 HD22 ' A' ' 92' ' ' LEU . 8.1 mt -62.13 -9.36 7.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.257 0.551 . . . . 0.0 110.256 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -123.82 -4.79 8.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.635 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.53 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 25.5 t0 -61.06 -29.16 69.57 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.148 0.499 . . . . 0.0 111.107 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.679 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 12.3 t70 55.13 26.24 8.03 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.473 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.509 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 45.9 t -86.28 -3.38 58.97 Favored 'General case' 0 C--N 1.334 -0.104 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.127 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.12 -70.87 2.71 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.867 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.99 -54.53 14.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.216 0.532 . . . . 0.0 109.636 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.764 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.5 t -68.86 -30.31 46.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.272 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.679 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 41.7 ttt180 -71.45 -63.29 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.819 0.342 . . . . 0.0 111.079 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 50.5 m -61.81 -21.29 64.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.269 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -65.19 -22.17 68.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.341 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.427 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -88.46 -49.85 6.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -44.16 -32.63 1.28 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.727 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' A' ' 75' ' ' ARG . 6.2 ptp180 -79.75 -34.18 40.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 0.0 110.969 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.455 ' HB2' HD22 ' A' ' 58' ' ' LEU . 70.9 m -63.77 -35.99 82.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.453 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.547 HD22 HD13 ' A' ' 58' ' ' LEU . 3.9 mm? -55.46 -59.13 5.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.836 0.35 . . . . 0.0 110.318 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.464 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 34.3 tt0 -63.6 -26.37 68.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.948 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.416 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 8.2 mt-30 -62.32 -51.2 68.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.63 179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.696 HG12 ' HG3' ' A' ' 50' ' ' GLN . 69.0 mt -65.73 -55.59 18.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.681 179.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.78 116.67 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.716 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 149.5 177.34 23.5 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.431 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -63.11 -22.41 66.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.815 0.34 . . . . 0.0 110.976 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.534 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -63.09 -58.76 6.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.388 -179.811 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.471 ' H ' ' HG2' ' A' ' 84' ' ' ARG . 4.2 m -70.48 -22.93 24.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.927 0.394 . . . . 0.0 111.288 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -58.71 -35.16 72.21 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.944 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.71 -29.05 67.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.287 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.7 70.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.691 179.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.59 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 17.7 mmm -68.51 -51.72 39.98 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.38 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -54.95 -35.96 64.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.904 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.6 tmtm? -77.73 -25.91 49.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.491 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.602 HD22 HD13 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -86.59 -21.56 26.75 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.156 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.73 -21.13 59.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.725 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -80.35 -24.79 39.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.286 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 81.4 p -122.55 14.82 10.28 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.434 ' C ' ' HB2' ' A' ' 101' ' ' ARG . . . -61.24 128.27 43.88 Favored Glycine 0 N--CA 1.444 -0.782 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.989 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.491 HG23 HH22 ' A' ' 70' ' ' ARG . 4.3 t -139.82 130.16 25.38 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.916 0.389 . . . . 0.0 111.169 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.06 -108.84 2.44 Favored Glycine 0 CA--C 1.519 0.302 0 C-N-CA 121.113 -0.565 . . . . 0.0 113.282 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 103' ' ' VAL . 53.3 t80 -85.6 -40.35 16.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.655 0.264 . . . . 0.0 111.541 -179.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.454 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -48.43 -38.1 18.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 112.059 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.434 ' HB2' ' C ' ' A' ' 96' ' ' GLY . 42.5 ttt180 -73.82 -56.49 4.91 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.492 ' HG3' ' ND2' ' A' ' 106' ' ' ASN . 2.2 tpmt? -46.67 -21.71 0.22 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.179 0.514 . . . . 0.0 110.813 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 99' ' ' PHE . 37.5 t -74.49 -59.69 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.912 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.534 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.37 -44.48 84.44 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.406 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 51.7 t -63.9 -64.07 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -177.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.492 ' ND2' ' HG3' ' A' ' 102' ' ' LYS . 91.8 m-20 -60.21 -37.57 80.7 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.59 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 24.8 t80 -60.74 -32.42 71.7 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 120.789 0.328 . . . . 0.0 111.074 -178.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 35.6 mt -54.19 -18.24 3.63 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.534 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -71.94 1.62 6.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.099 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 18.9 m -114.24 -80.09 0.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.187 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 61.0 m80 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.948 -179.966 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.3 tpt . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.846 0.355 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.85 -66.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.252 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -117.84 -83.1 0.64 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.117 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -159.03 47.99 0.32 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.925 0.393 . . . . 0.0 110.629 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.2 t30 60.55 10.26 2.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.923 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.505 ' NZ ' ' HB2' ' A' ' 6' ' ' LYS . 4.5 ttmp? -66.67 145.91 55.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.545 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.466 ' HB3' ' O ' ' A' ' 6' ' ' LYS . 0.3 OUTLIER 74.36 -37.45 0.36 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.566 0.541 . . . . 0.0 110.949 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.548 HG22 ' H ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER 50.23 175.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-O 121.591 0.71 . . . . 0.0 112.774 178.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.548 ' H ' HG22 ' A' ' 8' ' ' VAL . 14.7 mmm180 -91.29 44.65 1.2 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.794 -179.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.621 ' HA ' ' HG2' ' A' ' 22' ' ' GLU . 42.7 ttt180 -61.89 104.51 0.46 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 67.93 14.71 9.44 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.103 0.477 . . . . 0.0 109.971 -178.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 28.6 t -96.75 77.82 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.501 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.7 t 64.24 120.32 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.471 179.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.415 ' HB ' ' HB2' ' A' ' 17' ' ' SER . 29.5 p 57.84 139.06 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.825 178.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.26 -66.67 0.89 Allowed 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.558 ' H ' HD12 ' A' ' 16' ' ' LEU . 1.7 mp -86.16 -11.77 51.66 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.415 ' HB2' ' HB ' ' A' ' 14' ' ' THR . 48.0 t -44.8 -52.73 8.18 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 174.54 40.64 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.52 ' HB3' ' HB3' ' A' ' 22' ' ' GLU . 23.0 mmt -74.57 -6.71 50.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.782 0.325 . . . . 0.0 110.908 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.57 -105.49 1.08 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.911 -0.661 . . . . 0.0 113.115 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.12 -38.45 73.47 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.695 0.283 . . . . 0.0 111.368 -179.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.621 ' HG2' ' HA ' ' A' ' 10' ' ' ARG . 21.3 tp10 -80.65 -18.22 48.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.079 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.512 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -96.94 -2.95 42.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.702 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.478 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 11.7 t80 -54.71 -59.98 3.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.342 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.41 -55.56 34.38 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.106 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.512 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 98.5 Cg_exo -42.43 -31.66 1.93 Allowed 'Trans proline' 0 C--N 1.36 1.174 0 C-N-CA 122.298 1.998 . . . . 0.0 111.74 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.481 ' HB2' HH12 ' A' ' 53' ' ' ARG . 33.5 mt -67.91 -58.62 4.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.305 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.595 HD12 HD12 ' A' ' 31' ' ' LEU . 13.7 tp -62.06 -21.92 65.33 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.376 179.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -77.2 -27.47 53.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.634 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.468 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 74.1 m -64.43 -25.81 68.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.977 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.672 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 87.9 mt -65.27 -17.05 64.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.806 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.0 m -102.4 16.37 26.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.107 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.468 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 92.4 m-20 -95.29 143.88 26.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.995 0.426 . . . . 0.0 111.26 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -67.78 -16.51 64.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.903 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -85.33 160.7 19.75 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.66 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 7.3 p90 -109.17 -35.96 6.17 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.455 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.434 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 71.3 ttt180 -60.26 -32.07 70.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.824 0.345 . . . . 0.0 111.224 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 59.3 mt -82.43 -38.39 15.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.501 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.672 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 43.1 ttm180 -64.58 -46.79 81.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.423 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -59.49 -47.89 88.65 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.67 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.93 -27.96 54.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.716 0.293 . . . . 0.0 111.253 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.463 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.33 -56.42 22.36 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.038 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.402 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -65.54 -28.54 69.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.948 0.404 . . . . 0.0 110.801 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.3 m95 -55.4 -42.87 74.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.228 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.8 mt -99.08 -20.37 5.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.545 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.508 HD11 ' NH1' ' A' ' 53' ' ' ARG . 0.2 OUTLIER -56.81 -37.33 53.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.58 -179.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.01 -20.5 60.26 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.93 -0.653 . . . . 0.0 113.399 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -69.83 -21.12 63.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -82.61 -27.74 31.27 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.626 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.0 OUTLIER 57.66 27.25 13.99 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.94 0.4 . . . . 0.0 111.38 179.828 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -100.96 158.38 16.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.162 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -56.77 -36.75 70.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.477 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.523 ' HD2' ' O ' ' A' ' 53' ' ' ARG . 0.8 OUTLIER -63.73 -27.55 69.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.891 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.498 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -96.11 0.14 50.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.228 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.6 t -90.83 -41.05 13.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.392 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.555 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 19.1 tt0 -60.61 -49.18 91.02 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 50.5 Cg_exo -54.03 -17.35 10.93 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.647 2.231 . . . . 0.0 113.222 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.54 HD22 ' OG ' ' A' ' 76' ' ' SER . 12.9 mt -86.54 -31.79 21.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.844 0.354 . . . . 0.0 110.93 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.6 mm -63.33 -52.62 56.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.984 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -70.17 -44.55 68.54 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' ' 69' ' ' VAL . 2.0 tp -57.66 -35.74 70.96 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -177.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.709 HD13 HD22 ' A' ' 92' ' ' LEU . 35.2 mt -59.01 -12.08 4.22 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -113.08 -3.6 13.96 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.42 ' OD1' ' HA ' ' A' ' 61' ' ' LEU . 0.9 OUTLIER -60.98 -33.62 73.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.153 0.501 . . . . 0.0 111.117 179.945 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.532 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 17.9 t70 50.34 26.77 2.4 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.373 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.477 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.6 t -82.37 -17.34 45.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.943 0.401 . . . . 0.0 110.372 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 122.2 -114.45 2.5 Favored Glycine 0 N--CA 1.452 -0.254 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.444 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.434 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -55.06 -27.94 48.53 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.376 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.642 HG12 ' HG ' ' A' ' 61' ' ' LEU . 39.5 t -64.92 -38.94 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.621 178.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.532 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 44.1 ttp180 -74.69 -40.15 61.55 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.595 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 55.0 m -64.85 -33.74 76.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.09 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.35 -60.35 8.67 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.444 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.538 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . . . -57.12 -31.53 65.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.872 0.368 . . . . 0.0 111.048 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.97 -59.05 5.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.737 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -67.11 -37.51 84.0 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.098 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.54 ' OG ' HD22 ' A' ' 58' ' ' LEU . 60.7 p -53.29 -40.22 64.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.752 0.31 . . . . 0.0 111.237 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.421 ' HB3' HG13 ' A' ' 85' ' ' VAL . 35.2 mt -67.7 -60.17 2.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.828 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -53.18 -25.8 15.0 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.111 0.481 . . . . 0.0 110.219 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.462 HE21 ' HA ' ' A' ' 76' ' ' SER . 4.7 tt0 -68.23 -41.55 81.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.066 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.626 HG12 ' HG3' ' A' ' 50' ' ' GLN . 89.3 mt -63.13 -55.4 23.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.727 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.42 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 66.24 119.34 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.57 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.77 -179.97 27.92 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.278 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -66.38 -33.96 76.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.72 0.295 . . . . 0.0 110.922 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.512 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -62.97 -38.31 90.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.11 -179.78 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.431 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 19.8 t -64.8 -37.16 79.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.819 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 39.4 ttp180 -59.19 -27.36 65.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.513 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.29 76.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.025 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.65 88.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.929 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.54 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 14.4 mmt -66.77 -49.41 65.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.691 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -56.42 -34.98 67.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.82 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.14 -27.59 48.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.985 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.709 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -86.17 -19.79 29.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.16 0.505 . . . . 0.0 109.745 179.663 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.69 -19.95 60.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.692 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.51 -27.6 37.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.332 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 15.6 p -120.18 18.3 12.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.333 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -53.48 125.92 33.12 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.968 -1.015 . . . . 0.0 113.268 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.4 t -139.79 130.32 25.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.035 0.445 . . . . 0.0 110.845 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.23 -121.29 26.17 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.005 -0.617 . . . . 0.0 113.132 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -75.87 -36.53 59.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.66 0.267 . . . . 0.0 111.685 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.495 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.84 -39.72 59.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.871 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -66.33 -59.98 3.2 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.485 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -45.7 -32.85 2.64 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.869 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.442 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 19.9 t -58.98 -59.92 3.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.656 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.516 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.33 -56.4 22.56 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 88.6 t -59.46 -60.68 2.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -178.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -55.4 -37.42 67.58 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.54 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 43.5 t80 -62.84 -22.77 66.9 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 120.907 0.384 . . . . 0.0 110.958 -178.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.4 mt -58.39 -17.21 18.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.166 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -64.79 -24.08 67.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.662 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.1 p -102.39 -58.01 1.95 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.818 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 44.1 m80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.295 -0.86 . . . . 0.0 110.835 179.891 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.7 mmm . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.821 0.344 . . . . 0.0 110.948 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.18 6.45 1.53 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.096 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 60.25 11.89 3.06 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.255 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -145.49 -46.82 0.22 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.138 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -76.94 79.3 3.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.054 0.454 . . . . 0.0 111.555 -179.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -115.49 56.51 0.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.019 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 15.0 m95 63.33 15.99 9.13 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.115 -179.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.2 t -80.56 -51.09 16.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.861 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.526 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 99.1 mtt180 -137.26 -12.14 1.63 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.871 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 0.6 OUTLIER -61.48 104.29 0.4 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.262 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.462 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 27.1 t70 74.81 -19.34 0.39 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.283 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.526 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 60.4 t -56.25 -65.9 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.614 -179.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.9 t 68.04 -81.07 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.382 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 46.7 p -112.08 95.05 5.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.883 0.373 . . . . 0.0 111.515 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.651 ' HB1' ' HB2' ' A' ' 19' ' ' MET . . . -95.74 -2.54 47.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.371 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.653 ' H ' HD12 ' A' ' 16' ' ' LEU . 4.7 mp -56.92 -18.64 14.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.93 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 52.3 m -47.67 -52.1 19.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.484 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 174.49 7.43 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.745 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.651 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 11.3 mtp -61.65 -41.64 97.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.126 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.3 170.92 16.18 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.73 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.3 t70 62.37 -80.11 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.9 0.381 . . . . 0.0 110.843 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.82 -13.65 59.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.393 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.452 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -100.2 -0.18 39.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.395 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.499 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 1.5 t80 -63.34 -48.64 77.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.108 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.444 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 8.6 mt-10 -62.58 -58.1 18.76 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.949 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 11.8 Cg_endo -56.01 -15.54 14.01 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 121.859 1.706 . . . . 0.0 110.955 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.828 HD21 HG13 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -79.12 -38.81 35.24 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.593 179.293 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.502 HD11 ' HG2' ' A' ' 53' ' ' ARG . 7.4 mt -82.18 -22.17 36.14 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.383 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.13 -31.96 69.41 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.512 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.49 ' OG ' HG22 ' A' ' 38' ' ' ILE . 1.5 t -66.18 -26.52 67.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.638 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.589 ' HA ' ' HD2' ' A' ' 39' ' ' ARG . 76.4 mt -56.35 -17.74 8.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.864 -179.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.2 m -90.7 21.73 3.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.612 0.244 . . . . 0.0 111.491 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -114.27 123.37 49.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.988 0.423 . . . . 0.0 111.313 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -67.88 -5.6 17.55 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.375 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -75.89 155.85 34.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.791 0.329 . . . . 0.0 110.947 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.3 p-90 -89.79 -35.0 15.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.068 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -69.35 -33.24 72.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.901 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.49 HG22 ' OG ' ' A' ' 30' ' ' SER . 40.5 mm -82.11 -55.01 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.876 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.589 ' HD2' ' HA ' ' A' ' 31' ' ' LEU . 8.2 tpt180 -57.25 -40.37 77.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.053 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.27 -58.62 10.04 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.931 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.97 -27.31 0.88 Allowed 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.05 -56.78 9.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.843 0.354 . . . . 0.0 111.196 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.578 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -66.41 -37.22 84.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.953 0.406 . . . . 0.0 111.008 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -55.77 -33.4 64.31 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.723 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.3 mm -98.75 -20.45 5.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.187 0.518 . . . . 0.0 110.849 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.828 HG13 HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -60.74 -41.38 88.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.754 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.529 ' HA3' HE21 ' A' ' 79' ' ' GLN . . . -59.75 -16.08 36.75 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.716 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -70.73 -43.34 69.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.474 0.178 . . . . 0.0 111.227 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -92.82 105.7 17.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.78 0.324 . . . . 0.0 110.631 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' ' 80' ' ' ILE . 23.7 mp0 -71.82 74.37 0.86 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.524 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -127.82 155.49 44.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.161 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.409 ' HA ' HG23 ' A' ' 55' ' ' VAL . 9.4 pt-20 -64.92 -29.13 70.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.424 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.502 ' HG2' HD11 ' A' ' 28' ' ' LEU . 33.4 ttm180 -69.26 -10.43 57.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.337 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.611 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -105.97 12.97 29.94 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.882 0.372 . . . . 0.0 111.009 -179.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.409 HG23 ' HA ' ' A' ' 52' ' ' GLU . 53.2 t -86.63 -50.11 14.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.009 -0.542 . . . . 0.0 112.182 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 42.1 tt0 -55.08 -48.43 96.11 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 94.5 Cg_exo -45.47 -33.77 9.8 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.426 2.084 . . . . 0.0 112.987 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.428 HD22 ' HB2' ' A' ' 76' ' ' SER . 8.7 mt -75.17 -40.77 59.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.829 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.487 HD11 ' HA ' ' A' ' 88' ' ' ALA . 41.0 mm -54.78 -52.96 37.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.16 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -70.09 -22.33 63.05 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -178.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.602 ' HG ' HG12 ' A' ' 69' ' ' VAL . 3.0 mp -89.42 -40.13 12.93 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.526 HD11 HD11 ' A' ' 77' ' ' LEU . 13.3 mt -62.2 -10.88 11.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.349 0.595 . . . . 0.0 110.346 -179.238 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -90.67 -39.86 12.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.98 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.485 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 34.5 m-20 -56.52 -179.8 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.76 -178.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -153.33 29.7 0.49 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.762 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.424 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 53.3 m -83.66 -3.41 57.72 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.285 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.49 -98.75 2.41 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.392 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -48.69 -32.72 8.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.235 0.54 . . . . 0.0 110.012 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.602 HG12 ' HG ' ' A' ' 61' ' ' LEU . 60.1 t -72.8 -56.78 8.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.104 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 7.3 tmm_? -65.2 -63.66 1.05 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.339 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 97.3 p -52.05 -22.84 4.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.293 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -63.16 -43.65 98.33 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.594 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.51 ' O ' HD12 ' A' ' 77' ' ' LEU . . . -75.32 -36.84 61.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.573 0.225 . . . . 0.0 111.377 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.22 -40.47 64.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.526 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.3 ptp180 -84.45 -16.58 42.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.489 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.428 ' HB2' HD22 ' A' ' 58' ' ' LEU . 54.9 m -65.91 -45.05 83.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.792 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.54 ' HA ' HG21 ' A' ' 85' ' ' VAL . 5.0 mp -55.8 -59.4 4.93 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.454 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -53.74 -29.46 39.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.804 -0.18 . . . . 0.0 111.099 179.716 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.529 HE21 ' HA3' ' A' ' 47' ' ' GLY . 21.0 mt-30 -70.6 -31.99 69.18 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 121.018 0.437 . . . . 0.0 110.346 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.529 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 95.2 mt -80.43 -60.71 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.173 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.76 113.38 0.01 OUTLIER Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.978 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.91 164.1 12.0 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.633 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -64.03 -26.37 68.53 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.805 0.336 . . . . 0.0 110.837 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.556 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -65.95 -53.49 38.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.764 179.894 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.556 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 12.3 p -70.8 -24.77 25.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.389 0.614 . . . . 0.0 110.263 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.439 ' O ' ' HG3' ' A' ' 89' ' ' MET . 17.0 ttp180 -55.88 -20.87 17.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.72 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.02 -34.07 64.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.364 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.487 ' HA ' HD11 ' A' ' 59' ' ' ILE . . . -60.0 -48.58 81.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.851 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.542 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.23 -31.75 69.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.375 179.739 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.35 -36.51 83.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.164 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 42.7 mmtm -79.94 -28.11 39.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.121 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.491 HD22 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -82.48 -24.03 34.42 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.78 -12.49 61.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.738 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -95.86 -14.87 22.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.914 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.0 p -135.12 16.99 3.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.598 0.713 . . . . 0.0 109.199 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -61.5 148.19 47.22 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 114.734 -1.121 . . . . 0.0 113.226 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.426 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 4.3 t -151.25 130.35 12.65 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.79 -0.705 . . . . 0.0 111.001 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.03 -130.11 50.53 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.976 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.449 ' O ' HG23 ' A' ' 103' ' ' VAL . 78.0 t80 -60.42 -47.54 85.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.635 0.255 . . . . 0.0 111.389 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.435 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.17 -41.5 49.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.51 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.426 ' HB2' ' N ' ' A' ' 97' ' ' THR . 9.3 tpt180 -61.52 -61.68 2.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.384 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -53.3 -27.69 24.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.119 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 99' ' ' PHE . 13.5 t -63.97 -45.79 95.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.954 -179.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -62.56 -58.95 5.74 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 106' ' ' ASN . 7.3 p -64.43 -52.84 50.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.515 ' N ' HG13 ' A' ' 105' ' ' VAL . 27.1 t-20 -55.78 -32.49 63.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.646 0.26 . . . . 0.0 111.616 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -60.32 -29.24 68.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.058 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 14.1 mt -51.44 -22.36 2.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.65 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.74 3.69 3.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.268 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 53.7 m -105.37 -60.36 1.63 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.788 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.418 ' HD2' ' HD3' ' A' ' 86' ' ' ARG . 82.9 t60 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.638 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ttt . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.808 0.337 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.25 -16.27 38.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.157 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -86.13 -32.26 21.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.142 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -82.99 -10.28 58.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.949 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -158.38 127.68 5.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.883 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -127.33 -27.61 2.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.698 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 3.3 p-90 -152.02 122.23 7.2 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.874 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.631 HG23 ' HA ' ' A' ' 22' ' ' GLU . 2.4 p -128.62 -44.24 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.366 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 -109.25 -16.88 13.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.093 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.437 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 33.6 ttp180 -53.51 113.39 1.15 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.437 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 28.7 t70 75.01 -18.46 0.44 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.264 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.419 ' H ' ' C ' ' A' ' 10' ' ' ARG . 54.4 t -85.56 125.41 40.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.019 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 41.4 t -162.25 -21.48 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.544 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.5 m -144.57 8.78 1.35 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.233 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.0 -1.94 58.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.516 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.623 ' HA ' ' HB1' ' A' ' 23' ' ' ALA . 1.4 pt? -53.01 -13.84 0.51 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.476 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.5 t -54.68 -36.61 64.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.208 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -171.87 80.79 0.06 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.883 0.373 . . . . 0.0 111.747 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.616 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 20.7 mmt -133.94 -43.6 0.8 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.777 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.45 ' HA2' ' HZ ' ' A' ' 49' ' ' PHE . . . 76.35 144.89 1.62 Allowed Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.905 -0.665 . . . . 0.0 113.277 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 16.8 t70 62.38 -79.92 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 122.619 0.368 . . . . 0.0 111.763 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.631 ' HA ' HG23 ' A' ' 8' ' ' VAL . 12.8 pt-20 -62.72 -11.82 19.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.068 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.623 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -100.94 -6.22 24.88 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.666 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.424 ' HA ' HD23 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -59.47 -49.42 77.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.999 0.428 . . . . 0.0 110.805 -179.81 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.418 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 10.8 mt-10 -63.42 -58.92 13.43 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.438 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.463 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 15.0 Cg_endo -56.46 -14.38 12.6 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 121.87 1.714 . . . . 0.0 111.062 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.546 HD11 HG12 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -82.9 -39.0 22.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.535 178.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.429 HD12 HD12 ' A' ' 31' ' ' LEU . 8.7 tp -85.86 -21.38 28.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.325 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -75.81 -37.56 58.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.708 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 60.9 p -65.3 -23.99 67.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.27 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.429 HD12 HD12 ' A' ' 28' ' ' LEU . 86.2 mt -59.2 -7.26 1.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.673 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.5 p -89.92 19.62 4.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.21 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.614 HD21 ' HG3' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -88.19 147.76 24.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.138 0.494 . . . . 0.0 111.432 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.84 -25.74 65.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.622 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.1 162.32 28.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.968 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -110.12 -26.05 9.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.95 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 37' ' ' ARG . 23.4 ttt180 -58.9 -48.16 82.42 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.742 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.4 mm -56.44 -49.85 75.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.339 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.614 ' HG3' HD21 ' A' ' 33' ' ' ASN . 77.8 mtt180 -52.81 -23.84 7.73 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.598 178.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -60.78 -66.59 2.6 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.484 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.3 -42.33 69.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.778 0.323 . . . . 0.0 111.224 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.447 ' HB1' HD12 ' A' ' 27' ' ' LEU . . . -58.02 -54.9 41.73 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.676 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.82 -34.72 74.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.6 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -68.7 -28.07 66.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.773 -179.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.2 mm -91.41 -21.6 6.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.927 0.394 . . . . 0.0 110.54 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.648 HG23 ' HB1' ' A' ' 54' ' ' ALA . 2.4 mm -55.78 -35.16 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.251 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.91 -28.26 63.19 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.869 -0.681 . . . . 0.0 113.022 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.704 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.6 OUTLIER -55.4 -51.44 66.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.9 0.381 . . . . 0.0 110.255 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.45 ' HZ ' ' HA2' ' A' ' 20' ' ' GLY . 37.2 m-85 -83.98 115.58 22.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.741 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.68 25.4 0.78 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.132 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.506 ' O ' HG23 ' A' ' 55' ' ' VAL . 6.2 m-20 -84.0 162.45 20.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.376 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.441 ' H ' ' CD ' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -61.58 -37.06 82.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.589 -179.551 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.6 ttp180 -64.45 -11.32 32.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.986 0.422 . . . . 0.0 110.367 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.648 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -106.02 -10.99 16.3 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.709 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 51' ' ' ASP . 93.6 t -79.05 -44.51 24.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.654 -179.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.563 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -57.69 -51.06 84.51 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.496 -179.564 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.563 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.0 Cg_exo -45.29 -51.67 7.52 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.296 1.997 . . . . 0.0 112.252 179.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.522 HD22 ' HA ' ' A' ' 73' ' ' ALA . 16.7 mt -60.63 -35.57 76.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.484 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 55' ' ' VAL . 42.6 mm -62.78 -59.75 3.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.703 0.287 . . . . 0.0 111.585 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.457 ' H ' ' HG3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -70.07 -4.97 23.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.693 -179.341 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.726 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -89.59 -44.44 10.08 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -179.353 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.689 HD13 HD22 ' A' ' 92' ' ' LEU . 5.1 mt -56.74 -15.81 5.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.887 0.375 . . . . 0.0 111.4 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -110.85 -9.33 14.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.501 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.402 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.7 t70 -61.06 -33.43 73.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.108 0.48 . . . . 0.0 111.212 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.583 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 16.5 t70 54.84 28.98 11.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.688 179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.497 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 37.8 t -85.33 -10.94 55.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.636 0.255 . . . . 0.0 111.404 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 96.09 -84.33 0.85 Allowed Glycine 0 C--O 1.228 -0.26 0 C-N-CA 120.712 -0.756 . . . . 0.0 111.97 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.66 -41.52 98.2 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.726 HG12 ' HG ' ' A' ' 61' ' ' LEU . 5.2 t -71.97 -43.46 67.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.133 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.583 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 8.3 ttt180 -69.52 -63.36 1.09 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.703 0.287 . . . . 0.0 111.027 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.9 m -52.49 -23.06 5.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.821 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -66.9 -37.43 92.19 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.147 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.522 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -69.72 -47.47 62.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.649 0.261 . . . . 0.0 111.003 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.23 -26.2 62.58 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.214 0.531 . . . . 0.0 110.002 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.9 ttt180 -82.93 -40.45 20.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.449 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.654 ' HA ' HE21 ' A' ' 79' ' ' GLN . 69.8 m -66.94 -33.24 75.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.676 -179.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.553 HD11 HD11 ' A' ' 62' ' ' LEU . 96.8 mt -65.36 -59.72 3.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.675 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.426 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 36.8 tt0 -51.57 -23.09 3.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.161 0.505 . . . . 0.0 110.032 178.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.654 HE21 ' HA ' ' A' ' 76' ' ' SER . 1.1 tt0 -68.02 -48.14 66.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.985 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 82.2 mt -58.21 -60.22 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.713 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 61.13 107.16 0.01 OUTLIER Glycine 0 C--N 1.332 0.356 0 C-N-CA 121.092 -0.575 . . . . 0.0 113.07 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 155.33 -175.47 33.26 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.621 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -71.34 -26.81 62.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.842 0.353 . . . . 0.0 110.737 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.598 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -68.68 -49.71 56.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 -179.746 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.598 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 11.4 p -70.83 -26.93 28.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.276 0.56 . . . . 0.0 110.798 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.431 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 54.7 ttt180 -58.78 -24.59 62.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.532 -179.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.94 -29.0 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.93 0.395 . . . . 0.0 110.701 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.73 -37.68 88.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.71 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.537 ' SD ' HD13 ' A' ' 77' ' ' LEU . 6.7 mmm -66.76 -44.38 81.55 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 12.3 mm-40 -57.42 -38.63 74.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.146 178.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -74.49 -29.49 61.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.547 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.689 HD22 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -87.25 -23.48 24.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.005 0.431 . . . . 0.0 110.296 179.48 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.84 -29.16 69.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.422 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.539 ' HG3' HG23 ' A' ' 95' ' ' THR . 11.2 pt-20 -80.17 -18.13 50.53 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.245 0.545 . . . . 0.0 109.779 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.539 HG23 ' HG3' ' A' ' 94' ' ' GLU . 72.0 p -121.93 21.91 10.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.935 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.432 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -60.64 123.12 31.9 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 114.843 -1.071 . . . . 0.0 113.687 -178.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.3 t -147.76 130.06 15.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.809 0.337 . . . . 0.0 110.786 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.7 -132.77 20.42 Favored Glycine 0 CA--C 1.52 0.359 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.158 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -77.86 -30.89 51.13 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.658 0.266 . . . . 0.0 111.321 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.539 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -55.27 -37.92 67.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.468 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.432 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 44.5 ttt180 -67.41 -59.02 3.73 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.667 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.2 tppt? -47.33 -21.69 0.33 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.961 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.457 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 18.7 t -75.4 -56.98 7.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.92 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.514 ' O ' ' HG ' ' A' ' 108' ' ' LEU . . . -51.31 -57.6 8.44 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 113.502 0.926 . . . . 0.0 113.502 -178.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.8 t -58.35 -63.6 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -176.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -59.03 -35.2 72.91 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.532 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 42.9 t80 -63.29 -25.76 68.46 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-O 120.829 0.347 . . . . 0.0 111.116 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 96.8 mt -56.59 -20.79 22.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.882 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -62.65 -12.35 22.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.977 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.4 p -132.05 20.01 4.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.315 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 65.6 m80 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.172 -0.918 . . . . 0.0 111.065 179.59 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.6 ptm . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.846 0.355 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -167.33 103.28 0.52 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.174 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 61.11 10.33 2.86 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.43 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -89.08 -55.43 3.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.835 0.35 . . . . 0.0 110.816 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -100.77 93.61 5.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -67.61 -70.07 0.28 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.838 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 40.8 m95 -72.28 87.45 1.13 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.485 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.418 HG13 ' HG2' ' A' ' 9' ' ' ARG . 12.6 p -123.69 -27.0 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.284 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.418 ' HG2' HG13 ' A' ' 8' ' ' VAL . 8.4 ptp180 -145.54 -27.52 0.45 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.191 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.657 ' HE ' ' HA ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -58.87 137.61 57.71 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.468 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 9.3 m-20 68.38 2.9 3.5 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 123.341 0.4 . . . . 0.0 111.428 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 46.5 t -112.29 129.32 68.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.006 0.431 . . . . 0.0 111.54 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 41.1 t -161.65 -66.14 0.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.406 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 39.0 p -101.39 11.95 38.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.701 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.07 -1.76 57.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.15 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.432 HD23 ' N ' ' A' ' 16' ' ' LEU . 2.6 pt? -51.15 -16.56 0.5 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.678 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.6 t -50.57 -40.38 52.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.031 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -175.47 94.87 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.346 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 12.8 mmt -133.66 -43.19 0.83 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.091 179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 121.73 -102.23 0.8 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.622 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.446 ' HA ' ' HB2' ' A' ' 24' ' ' PHE . 3.1 p-10 -102.93 -26.98 12.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.877 0.37 . . . . 0.0 111.256 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -62.23 -32.15 72.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.46 -179.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.469 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.17 0.68 27.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.611 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.548 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 2.7 t80 -63.47 -48.84 76.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.819 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.523 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.3 -50.39 74.82 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -179.207 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.523 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 87.6 Cg_exo -41.93 -24.46 0.3 Allowed 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 122.204 1.936 . . . . 0.0 111.719 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 47.1 mt -76.06 -53.02 8.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.133 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 31' ' ' LEU . 24.6 tp -66.98 -24.16 66.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.889 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -76.27 -42.71 44.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.558 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 52.3 m -66.43 -11.18 50.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.981 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 28' ' ' LEU . 38.7 mt -67.17 -10.11 46.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.102 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.7 t -100.21 14.36 31.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.511 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -68.91 150.08 48.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.83 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -63.09 -39.4 94.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.038 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -76.12 156.75 33.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.797 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 7.5 m0 -99.93 -33.03 10.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.644 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -64.94 -46.72 80.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.864 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.3 mt -60.4 -39.27 80.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.603 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.611 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 39.0 ttm180 -63.78 -20.75 66.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.335 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.08 -57.56 11.61 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.778 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.66 -36.44 4.87 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.456 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -67.21 -50.86 59.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.91 0.386 . . . . 0.0 110.69 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.406 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -64.05 -32.77 74.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.989 179.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -70.8 -33.92 71.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.49 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.0 mt -99.21 -19.36 5.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.461 HD13 ' HG2' ' A' ' 57' ' ' PRO . 5.6 tt -59.31 -38.03 72.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -178.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.438 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -76.14 -14.01 82.69 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.512 -0.851 . . . . 0.0 112.505 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.642 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER -70.69 -15.46 62.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.558 0.218 . . . . 0.0 111.148 -179.697 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -83.02 -22.77 33.5 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.322 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 59.94 24.97 14.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.216 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -93.45 163.36 13.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.152 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.493 ' O ' HG22 ' A' ' 55' ' ' VAL . 13.4 tp10 -66.08 -35.37 80.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.98 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.8 ttm180 -64.3 -10.03 21.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.317 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.548 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -101.96 18.63 20.18 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.493 HG22 ' O ' ' A' ' 52' ' ' GLU . 20.4 m -91.8 -46.35 14.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.478 ' N ' HG23 ' A' ' 55' ' ' VAL . 4.6 tp10 -59.8 -49.45 91.56 Favored Pre-proline 0 CA--C 1.531 0.216 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 84.0 Cg_exo -45.16 -53.08 5.7 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.993 1.795 . . . . 0.0 111.895 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.479 HD22 ' HB2' ' A' ' 76' ' ' SER . 7.8 mt -57.61 -36.81 72.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.13 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 74.9 mt -63.47 -59.53 4.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.416 ' HG3' HD13 ' A' ' 61' ' ' LEU . 13.6 pttm -66.28 -37.64 85.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.795 0.331 . . . . 0.0 111.631 -178.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.748 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -54.48 -51.82 63.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.923 -179.456 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.486 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 75.1 mt -58.35 -15.85 12.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.876 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.04 -22.94 15.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.586 179.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -61.34 -36.17 79.44 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.089 0.471 . . . . 0.0 111.302 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.539 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 20.3 t70 57.44 28.06 14.87 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.019 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.51 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 8.0 t -73.35 -11.86 60.63 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.747 0.308 . . . . 0.0 111.116 -179.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 99.34 -79.01 0.51 Allowed Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.08 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.96 -39.27 69.47 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.748 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.5 t -71.79 -41.49 70.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.84 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.539 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 6.2 tmm_? -67.73 -58.54 4.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.179 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.0 m -57.75 -35.13 70.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.7 -179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -55.75 -30.29 56.23 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.72 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.28 -52.02 15.47 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -45.98 -47.41 16.66 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -70.13 -30.13 67.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.604 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.651 ' HA ' HE21 ' A' ' 79' ' ' GLN . 50.3 m -65.22 -38.64 91.04 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.435 ' HG ' HG11 ' A' ' 85' ' ' VAL . 8.2 mp -55.56 -59.36 4.94 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.775 0.321 . . . . 0.0 111.026 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 41.7 mt-10 -55.46 -35.96 66.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.974 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.651 HE21 ' HA ' ' A' ' 76' ' ' SER . 22.1 mt-30 -61.99 -23.63 66.54 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.509 HG22 ' HD2' ' A' ' 84' ' ' ARG . 39.8 mt -90.22 -61.72 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.444 ' N ' ' NH1' ' A' ' 84' ' ' ARG . . . 64.33 125.62 0.01 OUTLIER Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.962 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.458 ' O ' ' NH2' ' A' ' 84' ' ' ARG . . . 141.97 -169.95 25.1 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.611 -0.804 . . . . 0.0 113.149 179.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' A' ' 86' ' ' ARG . 34.8 tt0 -72.91 -22.51 60.73 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.77 ' NE ' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.27 -65.38 0.68 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.187 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.77 ' H ' ' NE ' ' A' ' 84' ' ' ARG . 47.8 t -70.8 -20.52 22.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.08 0.467 . . . . 0.0 109.822 178.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.591 ' HA ' ' HE2' ' A' ' 89' ' ' MET . 2.2 tmm_? -46.25 -36.25 5.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.207 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -86.22 -27.86 24.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.705 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.441 ' HB3' HG13 ' A' ' 85' ' ' VAL . . . -65.19 -49.57 69.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.902 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.591 ' HE2' ' HA ' ' A' ' 86' ' ' ARG . 9.3 ptt? -58.73 -41.56 86.72 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.84 0.352 . . . . 0.0 110.294 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -63.2 -29.97 71.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.026 0.441 . . . . 0.0 109.855 178.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.451 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 10.8 tmtt? -71.06 -42.17 69.77 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.562 179.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.625 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -74.8 -24.47 58.65 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.543 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.16 -27.68 64.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.46 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -81.57 -26.58 34.85 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.619 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 74.1 p -109.67 20.91 17.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.352 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -55.41 115.59 5.96 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.027 -0.988 . . . . 0.0 113.441 -178.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.6 m -140.0 129.91 24.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.719 0.295 . . . . 0.0 110.697 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.18 -141.92 46.97 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.812 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -63.83 -25.28 68.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 111.202 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.563 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -55.63 -44.07 76.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.815 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.459 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 34.3 ttp180 -64.07 -53.77 44.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.704 0.288 . . . . 0.0 111.412 -179.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.6 tptp -50.28 -22.04 1.62 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.887 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.563 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 4.8 t -73.16 -57.58 6.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.901 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.625 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.32 -52.66 64.44 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 51.1 t -60.7 -45.87 96.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.52 ' N ' HD22 ' A' ' 106' ' ' ASN . 0.9 OUTLIER -70.75 -39.03 73.53 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.166 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.515 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 41.2 t80 -63.51 -23.92 67.59 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-O 121.163 0.506 . . . . 0.0 111.024 -178.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.493 ' HG ' ' HE3' ' A' ' 89' ' ' MET . 0.5 OUTLIER -49.98 -30.87 11.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.88 179.516 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.579 ' HG3' HG23 ' A' ' 110' ' ' THR . 12.1 pt-20 -65.12 -8.89 18.79 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.579 HG23 ' HG3' ' A' ' 109' ' ' GLU . 62.9 p -130.44 19.12 5.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.618 0.247 . . . . 0.0 111.42 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.2 m80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.994 179.866 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.8 mmm . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.835 0.35 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.43 -52.48 4.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.143 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -143.47 105.98 4.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.056 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -154.98 -60.67 0.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.649 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.438 HD22 HG22 ' A' ' 8' ' ' VAL . 0.6 OUTLIER -71.1 106.15 3.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.568 179.634 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -168.79 -0.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.992 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -131.72 10.16 4.68 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.325 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.5 HG21 ' HB2' ' A' ' 21' ' ' ASP . 31.5 m -90.44 44.27 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.218 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.469 ' HD3' ' HA2' ' A' ' 20' ' ' GLY . 33.2 ptt180 -159.5 -9.94 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.505 -179.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -53.94 105.26 0.13 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.356 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.4 t70 71.6 43.37 0.59 Allowed 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.291 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.474 ' O ' ' HB2' ' A' ' 17' ' ' SER . 38.3 t -141.01 109.87 2.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.333 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.535 ' HB3' HG21 ' A' ' 45' ' ' ILE . 9.7 p 64.55 -173.67 0.17 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.96 179.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.7 p -119.59 -76.17 0.58 Allowed 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.277 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.76 77.49 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.185 0.517 . . . . 0.0 110.555 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.726 HD13 ' HB2' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -79.28 -13.53 59.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.381 -179.559 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.474 ' HB2' ' O ' ' A' ' 12' ' ' VAL . 10.8 t -86.93 -5.56 59.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.186 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 18' ' ' ARG . 29.8 ttp180 -102.43 3.59 37.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.525 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.776 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 14.7 mmt -125.81 -41.38 1.98 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.763 0.315 . . . . 0.0 110.924 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.469 ' HA2' ' HD3' ' A' ' 9' ' ' ARG . . . 110.49 -144.82 17.18 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.754 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.5 ' HB2' HG21 ' A' ' 8' ' ' VAL . 23.4 t70 -63.54 -26.88 68.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.744 0.306 . . . . 0.0 110.605 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.63 -18.19 65.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.222 0.534 . . . . 0.0 110.148 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.776 ' HB2' ' HB2' ' A' ' 19' ' ' MET . . . -83.9 -12.49 55.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.132 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.494 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -59.38 -50.62 73.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.652 -179.604 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.437 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -57.56 -57.36 25.83 Favored Pre-proline 0 C--N 1.325 -0.5 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.185 -179.935 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.527 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 1.1 Cg_endo -49.95 -26.39 14.12 Favored 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 121.944 1.763 . . . . 0.0 111.099 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.726 ' HB2' HD13 ' A' ' 16' ' ' LEU . 0.4 OUTLIER -73.75 -41.93 61.8 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.104 178.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.692 HD12 HD12 ' A' ' 31' ' ' LEU . 7.2 tp -76.84 -17.97 58.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.155 -0.93 . . . . 0.0 109.492 178.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -70.65 -32.36 69.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.619 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.431 ' OG ' HG22 ' A' ' 38' ' ' ILE . 23.3 t -65.93 -27.09 67.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.188 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.692 HD12 HD12 ' A' ' 28' ' ' LEU . 69.8 mt -66.52 -9.91 39.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.859 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 43.3 t -93.88 16.89 13.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.1 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -100.58 139.42 36.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.931 0.396 . . . . 0.0 111.144 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.69 -16.95 64.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.328 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -78.9 127.51 32.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.845 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -82.41 -27.39 32.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.132 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -62.96 -48.09 80.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.856 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.431 HG22 ' OG ' ' A' ' 30' ' ' SER . 62.0 mt -73.07 -44.36 56.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.015 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.675 ' HG3' HD23 ' A' ' 31' ' ' LEU . 42.8 ttp180 -59.51 -27.5 66.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.821 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.83 -58.43 14.63 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.499 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.52 -42.72 67.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.673 0.273 . . . . 0.0 111.519 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.428 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.97 -56.16 24.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.856 0.36 . . . . 0.0 111.059 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.424 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -61.19 -31.4 71.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.256 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -69.93 -34.93 74.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.694 -0.684 . . . . 0.0 112.736 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.555 ' HA ' HD22 ' A' ' 48' ' ' ASN . 26.1 mm -98.93 -19.47 5.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.858 0.361 . . . . 0.0 111.843 -178.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.642 ' HA ' HD21 ' A' ' 27' ' ' LEU . 5.8 tt -57.23 -36.63 52.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.932 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.584 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -76.69 -12.55 84.36 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.457 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.555 HD22 ' HA ' ' A' ' 45' ' ' ILE . 21.4 m-80 -68.77 -21.17 64.37 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -83.85 -36.22 23.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.62 0.248 . . . . 0.0 111.249 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.562 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.8 OUTLIER 68.38 55.81 0.5 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.123 179.735 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.455 ' O ' HG23 ' A' ' 55' ' ' VAL . 7.5 m-20 -127.79 -178.28 4.44 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.02 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -63.36 -38.44 91.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.954 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -65.7 -12.08 50.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.052 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.9 7.51 32.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.051 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 51' ' ' ASP . 86.1 t -91.37 -59.28 3.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.412 -178.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.44 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 22.5 tt0 -60.09 -49.4 91.17 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.44 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 83.1 Cg_exo -42.56 -52.78 4.2 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.334 2.023 . . . . 0.0 112.86 -179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.528 HD22 ' HA ' ' A' ' 73' ' ' ALA . 12.0 mt -59.81 -34.76 73.47 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.741 -179.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 55' ' ' VAL . 51.3 mm -63.44 -59.89 3.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.83 -6.37 37.44 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.698 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -89.42 -37.13 15.04 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.478 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.534 HD13 HD22 ' A' ' 92' ' ' LEU . 5.9 mt -62.97 -9.64 10.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.492 . . . . 0.0 110.651 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -112.48 -12.61 13.47 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.995 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.438 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.0 t0 -61.03 -30.05 70.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.256 0.55 . . . . 0.0 110.668 179.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.442 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 38.5 m-20 48.58 30.62 2.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.698 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.521 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 18.4 t -83.82 -5.66 59.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.717 0.294 . . . . 0.0 111.118 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.12 -80.55 1.2 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.279 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -67.52 -43.8 79.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.123 0.487 . . . . 0.0 109.824 179.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.698 HG12 ' HG ' ' A' ' 61' ' ' LEU . 42.3 t -73.45 -38.53 53.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.576 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.442 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 4.8 tmm_? -72.55 -62.62 1.38 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.09 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.2 t -51.99 -27.76 14.55 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.865 0.364 . . . . 0.0 110.813 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.49 -45.76 95.02 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.097 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.528 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -59.89 -45.26 93.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.945 0.402 . . . . 0.0 110.49 179.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.567 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.84 -24.68 67.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.571 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 ttt85 -83.64 -39.01 20.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.333 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.584 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 51.5 m -66.66 -35.82 81.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.01 -179.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.52 HD22 HG13 ' A' ' 85' ' ' VAL . 77.7 mt -55.5 -60.12 3.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.737 0.303 . . . . 0.0 111.226 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -53.98 -29.38 42.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.952 0.406 . . . . 0.0 110.289 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.44 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 48.1 mt-30 -70.41 -38.76 74.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.292 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.562 HG12 ' HG3' ' A' ' 50' ' ' GLN . 67.8 mt -75.89 -61.08 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.149 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.522 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 57.99 110.64 0.01 OUTLIER Glycine 0 C--N 1.332 0.312 0 C-N-CA 121.154 -0.546 . . . . 0.0 113.207 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.95 -171.36 37.0 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.769 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -62.56 -40.35 96.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.844 0.354 . . . . 0.0 110.632 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.404 ' H ' ' CD ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -58.48 -43.81 89.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.448 179.81 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.522 HG21 ' N ' ' A' ' 81' ' ' GLY . 2.2 t -70.94 -27.58 30.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.589 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HA ' ' SD ' ' A' ' 89' ' ' MET . 0.0 OUTLIER -55.9 -31.44 62.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.804 -179.697 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.52 -19.62 30.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.818 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.87 -50.94 53.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.572 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.405 ' SD ' ' HA ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -72.17 -28.64 63.35 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.815 0.341 . . . . 0.0 110.883 -179.566 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -69.59 -33.03 72.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.801 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -80.66 -25.4 38.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.088 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.708 HD21 ' O ' ' A' ' 100' ' ' ALA . 3.9 tp -86.71 -31.27 21.1 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.93 -26.48 62.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.713 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -79.97 -29.1 39.52 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 36.3 p -110.59 25.88 11.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.982 178.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.516 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -47.14 108.64 0.31 Allowed Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.62 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.5 p -142.7 130.51 21.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.924 0.393 . . . . 0.0 111.241 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.58 -141.37 47.72 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.084 -0.579 . . . . 0.0 113.349 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.459 ' O ' HG23 ' A' ' 103' ' ' VAL . 28.0 t80 -68.35 -27.26 66.1 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 122.465 0.306 . . . . 0.0 111.68 -179.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.708 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -54.52 -47.71 72.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.878 0.37 . . . . 0.0 111.738 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.516 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 45.9 ttp180 -56.41 -59.97 4.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.802 -179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -45.57 -25.76 0.5 Allowed 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.953 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.585 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 52.6 t -74.68 -56.51 8.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.608 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.534 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -53.84 -47.25 71.14 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.556 ' HA ' HD12 ' A' ' 108' ' ' LEU . 48.8 t -65.48 -55.52 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -62.72 -43.74 98.03 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.416 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 31.0 t80 -60.51 -27.56 67.7 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 120.889 0.376 . . . . 0.0 111.527 -178.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.556 HD12 ' HA ' ' A' ' 105' ' ' VAL . 9.9 mt -56.58 -21.51 27.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.537 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -77.06 4.43 10.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.582 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 5.2 m -111.38 -75.76 0.61 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.749 0.309 . . . . 0.0 111.051 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.819 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.5 mtt . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.843 0.354 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.26 21.61 8.36 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.446 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -152.01 136.46 16.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.874 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 59.09 14.06 3.26 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.973 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -142.51 -45.49 0.32 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.859 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt 63.27 -79.15 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.811 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 2.2 p-90 -134.26 115.94 14.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.15 0.5 . . . . 0.0 110.797 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.498 HG23 ' HG3' ' A' ' 9' ' ' ARG . 30.5 m -133.96 -33.36 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.299 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.553 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -164.55 -1.44 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.715 179.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.49 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 48.4 ttp180 -62.77 108.61 1.21 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 178.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 5.9 m-20 70.57 11.67 7.31 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.46 -179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.553 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 55.8 t -86.36 -67.1 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.491 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.425 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 35.1 t 73.23 -27.59 0.19 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.663 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.574 ' HB ' ' HB3' ' A' ' 17' ' ' SER . 79.1 p -80.91 139.5 35.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.677 0.275 . . . . 0.0 110.807 179.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.82 -67.8 0.83 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.453 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.1 pt? -86.17 -21.02 27.75 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 -178.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.574 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 25.3 t -64.78 -52.79 55.03 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -178.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 17' ' ' SER . 53.3 ttp180 175.07 111.0 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.731 -179.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.592 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -133.47 -38.43 0.93 Allowed 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.623 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.448 ' N ' ' SD ' ' A' ' 19' ' ' MET . . . 152.97 -102.73 0.23 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.342 -0.933 . . . . 0.0 113.031 -179.337 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.484 ' HA ' ' HB2' ' A' ' 24' ' ' PHE . 4.2 p-10 -137.67 -23.46 1.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.669 0.271 . . . . 0.0 111.268 -179.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 23' ' ' ALA . 9.9 pt-20 -61.2 -42.2 98.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.295 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.592 ' HB3' ' HG2' ' A' ' 19' ' ' MET . . . -103.5 16.8 25.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.39 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.565 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.2 t80 -63.34 -46.91 84.43 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.841 0.353 . . . . 0.0 110.316 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' A' ' 27' ' ' LEU . 37.1 mt-10 -43.34 -54.24 10.04 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.501 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 53.7 Cg_exo -35.99 -31.05 0.08 OUTLIER 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.515 2.143 . . . . 0.0 112.011 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.495 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 75.2 mt -71.71 -57.55 4.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.132 178.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.561 HD22 HD12 ' A' ' 31' ' ' LEU . 3.4 tm? -55.5 -39.66 70.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.726 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -62.75 -29.37 70.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.336 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 29.1 t -64.53 -20.42 66.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.428 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.617 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 59.5 mt -69.63 -11.74 61.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.805 0.336 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.2 m -101.99 14.61 31.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.004 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -94.05 139.51 30.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.883 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 34' ' ' GLU . 2.9 mp0 -63.22 -17.9 62.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.8 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -77.2 155.68 32.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.139 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -110.83 -39.31 4.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.667 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -60.03 -34.24 73.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.976 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.1 mt -82.61 -42.98 18.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.265 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.617 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 40.6 ttm180 -58.66 -47.54 84.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.395 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.03 -56.23 26.3 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.687 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.36 -33.76 21.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.772 0.32 . . . . 0.0 111.224 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.81 -47.48 84.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.599 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -76.6 -23.69 53.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.156 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.2 m95 -61.13 -38.39 86.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.011 0.434 . . . . 0.0 110.588 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.0 mm -99.86 -18.71 6.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.267 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.599 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -50.09 -44.61 22.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.17 -178.882 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.419 ' N ' ' CG2' ' A' ' 46' ' ' ILE . . . -72.53 -14.68 77.48 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.617 -0.801 . . . . 0.0 113.04 -179.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -70.69 -10.6 59.78 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.552 0.205 . . . . 0.0 111.552 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -92.75 -26.05 17.92 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.636 ' HG3' HG12 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 62.51 51.03 3.38 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.942 0.401 . . . . 0.0 111.123 -179.849 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -127.17 171.28 11.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.99 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.75 -36.56 83.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.794 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -66.61 -9.61 37.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.771 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.565 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -100.99 3.86 41.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.648 -179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 47.6 t -92.06 -53.23 9.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.246 -179.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.558 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 12.7 tt0 -60.15 -51.21 81.98 Favored Pre-proline 0 CA--C 1.533 0.289 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -178.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 82.8 Cg_exo -46.58 -37.31 20.08 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.332 2.021 . . . . 0.0 112.649 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.466 ' HB3' HD11 ' A' ' 77' ' ' LEU . 48.9 mt -65.77 -40.55 92.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.065 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.459 HD11 ' HA ' ' A' ' 88' ' ' ALA . 46.7 mm -52.77 -54.38 16.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.294 -0.412 . . . . 0.0 112.08 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.82 74.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.042 -178.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.786 HD23 ' H ' ' A' ' 73' ' ' ALA . 0.3 OUTLIER -64.52 -37.54 87.91 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -178.284 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.507 ' HB3' HD22 ' A' ' 92' ' ' LEU . 34.9 mt -59.72 -13.73 11.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.306 0.574 . . . . 0.0 110.104 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -112.51 -13.43 13.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.241 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.477 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.6 OUTLIER -61.25 93.99 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.759 179.639 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -75.04 33.95 0.1 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.083 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.474 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 10.8 t -79.36 -27.11 41.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.972 0.415 . . . . 0.0 110.404 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.74 -110.12 1.13 Allowed Glycine 0 N--CA 1.453 -0.186 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.097 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -54.68 -25.46 27.31 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.596 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.3 t -64.72 -47.28 89.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.047 178.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.408 ' NH1' ' HB3' ' A' ' 99' ' ' PHE . 1.6 ttm180 -54.58 -54.44 41.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.948 0.404 . . . . 0.0 110.423 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 80.7 p -67.24 -16.59 64.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.071 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.565 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -52.53 -67.55 2.02 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.519 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.786 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -59.24 -36.51 75.6 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.538 0.209 . . . . 0.0 111.173 179.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -45.35 -56.38 5.01 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.574 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 72' ' ' GLY . 0.0 OUTLIER -70.2 -26.73 64.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.144 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.629 ' HA ' HE21 ' A' ' 79' ' ' GLN . 51.8 m -64.77 -39.27 93.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.74 0.305 . . . . 0.0 111.032 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.466 HD11 ' HB3' ' A' ' 58' ' ' LEU . 4.8 mp -61.08 -60.45 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.873 0.368 . . . . 0.0 110.55 179.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -57.21 -19.93 23.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.636 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.629 HE21 ' HA ' ' A' ' 76' ' ' SER . 3.3 tt0 -68.08 -56.99 6.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.432 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.656 ' HB ' HG21 ' A' ' 85' ' ' VAL . 82.7 mt -64.99 -60.59 2.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.143 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.12 102.37 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.451 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 174.83 -174.6 46.76 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.673 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -68.5 -37.03 79.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.872 0.368 . . . . 0.0 110.88 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.49 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -59.91 -46.19 90.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.528 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.656 HG21 ' HB ' ' A' ' 80' ' ' ILE . 21.3 t -70.88 -25.14 25.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.147 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 -58.42 -35.01 71.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.55 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.33 -21.85 48.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.386 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.459 ' HA ' HD11 ' A' ' 59' ' ' ILE . . . -71.4 -41.86 69.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.287 179.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.672 ' HE1' HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -72.26 -35.0 68.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.136 179.6 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -60.43 -44.88 95.33 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.513 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 3.8 tmtp? -62.34 -32.53 73.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.838 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.698 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.6 OUTLIER -83.06 -25.48 32.04 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.73 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.01 -18.92 64.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.332 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -80.3 -31.04 38.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.873 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.4 p -115.83 22.13 13.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.56 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.431 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -55.27 119.09 11.78 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.255 -0.884 . . . . 0.0 113.339 -178.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 26.0 m -143.83 129.11 18.83 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.744 0.306 . . . . 0.0 110.804 178.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.24 -136.34 51.05 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.861 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.495 ' O ' HG23 ' A' ' 103' ' ' VAL . 64.3 t80 -60.86 -38.01 84.1 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.797 0.332 . . . . 0.0 110.711 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.553 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.71 -41.59 56.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.879 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.431 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 38.6 ttt180 -68.91 -59.54 2.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.793 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -46.29 -23.97 0.42 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.917 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 99' ' ' PHE . 24.9 t -66.16 -60.31 2.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.276 179.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.698 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.48 -52.0 67.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.968 0.413 . . . . 0.0 111.774 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 61.7 t -57.69 -61.72 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.496 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -58.62 -30.06 66.98 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -59.71 -27.05 66.12 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.017 0.437 . . . . 0.0 110.49 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.672 HD11 ' HE1' ' A' ' 89' ' ' MET . 18.2 mt -59.99 -29.3 68.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.448 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -52.45 -25.75 10.91 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.152 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.8 p -101.91 -50.67 3.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.037 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.896 -179.817 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 mpp? . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.762 0.315 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.37 -169.44 1.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.262 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -87.62 -7.08 57.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.722 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -84.43 19.19 1.99 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.782 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -79.58 17.15 0.92 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.177 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -93.68 -14.29 26.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.314 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -91.81 18.86 7.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.721 0.296 . . . . 0.0 111.316 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.1 p -102.93 152.27 5.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.316 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.531 ' H ' ' HB3' ' A' ' 21' ' ' ASP . 13.1 ptp180 43.32 24.94 0.06 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.368 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.406 ' C ' ' H ' ' A' ' 12' ' ' VAL . 20.5 mmm180 -71.56 103.84 3.11 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.6 t70 71.07 -10.32 0.77 Allowed 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.211 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.406 ' H ' ' C ' ' A' ' 10' ' ' ARG . 9.7 t -117.0 157.69 17.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.032 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.403 ' N ' HG12 ' A' ' 12' ' ' VAL . 55.3 m -156.88 13.11 0.26 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.279 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.657 HG23 ' HA ' ' A' ' 18' ' ' ARG . 88.2 m -150.34 92.52 1.88 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.231 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.814 ' HB3' ' HB3' ' A' ' 23' ' ' ALA . . . -95.96 -73.07 0.61 Allowed 'General case' 0 C--O 1.232 0.15 0 C-N-CA 120.371 -0.532 . . . . 0.0 111.523 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.459 ' H ' ' HB3' ' A' ' 23' ' ' ALA . 9.8 tt -90.75 -68.63 0.78 Allowed 'General case' 0 C--O 1.231 0.104 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.445 178.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.48 ' O ' ' HB2' ' A' ' 18' ' ' ARG . 47.5 t -91.89 -53.4 4.29 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.241 178.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.657 ' HA ' HG23 ' A' ' 14' ' ' THR . 66.3 ttt180 171.74 64.08 0.0 OUTLIER 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.752 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.568 ' SD ' ' HB2' ' A' ' 23' ' ' ALA . 8.3 mtp -125.28 -43.68 1.92 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.402 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.65 ' H ' ' H ' ' A' ' 15' ' ' ALA . . . 77.26 100.39 0.17 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.92 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.531 ' HB3' ' H ' ' A' ' 9' ' ' ARG . 15.8 t70 70.56 -21.63 0.19 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 122.606 0.363 . . . . 0.0 111.816 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.47 ' H ' ' C ' ' A' ' 20' ' ' GLY . 27.4 tt0 -85.65 -24.86 26.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.975 0.417 . . . . 0.0 110.405 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.814 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . . . -95.93 9.24 41.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.164 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.524 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 3.0 t80 -63.35 -46.45 86.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.925 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.436 ' O ' ' N ' ' A' ' 27' ' ' LEU . 6.4 mm-40 -63.4 -51.95 64.1 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.675 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.508 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 95.8 Cg_exo -42.93 -19.12 0.12 Allowed 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 122.427 2.085 . . . . 0.0 111.926 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.521 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.2 mt -85.66 -52.39 5.83 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.159 178.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.598 HD12 HD12 ' A' ' 31' ' ' LEU . 52.5 tp -59.29 -33.65 71.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.728 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 26' ' ' PRO . 8.6 pt-20 -61.99 -28.42 69.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.843 0.354 . . . . 0.0 110.745 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.402 ' HB3' ' HB2' ' A' ' 42' ' ' ALA . 32.8 t -63.69 -21.39 66.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.516 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.643 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 42.0 mt -67.5 -6.74 21.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.696 0.284 . . . . 0.0 111.047 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 91.5 p -113.94 20.45 15.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.318 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.04 150.42 21.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.87 0.367 . . . . 0.0 111.184 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.95 -29.18 69.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.048 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -78.29 160.69 27.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.926 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.9 p90 -111.15 -39.6 4.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.177 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -59.68 -34.65 73.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.933 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 77.7 mt -76.86 -42.52 33.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.683 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.643 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 27.5 ttm180 -54.16 -32.18 54.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.71 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.4 -47.07 65.19 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.232 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.3 -24.81 12.63 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.759 0.314 . . . . 0.0 111.138 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.414 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -68.58 -57.42 5.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.388 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.82 -17.5 62.15 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.24 0.543 . . . . 0.0 110.582 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -46.79 87.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.183 -179.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.456 ' HA ' HD22 ' A' ' 48' ' ' ASN . 12.6 mt -98.53 -24.32 4.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.414 ' HB ' ' O ' ' A' ' 42' ' ' ALA . 5.1 tt -56.44 -24.59 19.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.685 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 76' ' ' SER . . . -74.44 -27.43 65.63 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.905 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.456 HD22 ' HA ' ' A' ' 45' ' ' ILE . 43.5 m-80 -59.84 -22.31 62.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.646 0.26 . . . . 0.0 111.471 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -105.07 107.73 18.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.425 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.754 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.4 mp0 -65.91 78.87 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.139 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -127.61 153.86 45.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.514 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.613 ' O ' HG22 ' A' ' 55' ' ' VAL . 13.5 pt-20 -64.91 -28.44 69.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.443 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -69.33 -12.12 61.39 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.363 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.524 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -104.37 21.94 15.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 52' ' ' GLU . 32.7 m -91.75 -57.88 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.717 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.581 ' N ' HG23 ' A' ' 55' ' ' VAL . 28.7 tt0 -60.31 -50.52 85.47 Favored Pre-proline 0 CA--C 1.533 0.319 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.5 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 95.1 Cg_exo -40.37 -52.03 3.15 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.495 2.13 . . . . 0.0 112.99 -179.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.451 HD22 ' OG ' ' A' ' 76' ' ' SER . 4.1 mt -62.97 -46.67 86.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.717 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 55' ' ' VAL . 47.6 mm -56.82 -56.24 15.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -70.09 -16.99 63.2 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.734 ' HG ' HG13 ' A' ' 69' ' ' VAL . 11.4 tp -90.47 -40.7 11.86 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -177.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.498 ' HA ' ' HA ' ' A' ' 70' ' ' ARG . 2.9 pp -64.6 -9.76 21.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.76 0.314 . . . . 0.0 111.657 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.479 ' HG3' HD12 ' A' ' 62' ' ' LEU . 24.0 mt-10 -98.81 -11.87 21.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.553 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.421 ' HB3' ' CG1' ' A' ' 69' ' ' VAL . 7.0 t70 -62.58 -30.64 71.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.175 0.512 . . . . 0.0 111.339 -179.077 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.683 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 12.3 m-20 63.6 23.94 13.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.935 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.418 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 25.8 t -83.68 1.37 42.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.603 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.625 ' H ' ' HG2' ' A' ' 70' ' ' ARG . . . 84.8 -94.17 1.86 Allowed Glycine 0 C--O 1.227 -0.311 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.671 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -49.33 -44.88 44.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.41 0.624 . . . . 0.0 110.066 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.734 HG13 ' HG ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -63.4 -44.76 99.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.076 -0.966 . . . . 0.0 112.271 -178.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.683 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 13.6 ptt180 -78.44 -22.48 47.56 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 67.6 m -66.85 -52.11 47.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.588 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -52.73 -47.73 57.9 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.013 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.43 ' HB1' ' O ' ' A' ' 58' ' ' LEU . . . -56.56 -39.27 73.17 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.019 0.438 . . . . 0.0 110.882 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.87 -54.2 45.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.782 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 71' ' ' SER . 6.6 ptp180 -70.99 -27.26 63.57 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.451 ' OG ' HD22 ' A' ' 58' ' ' LEU . 32.0 p -63.33 -40.04 96.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.454 0.169 . . . . 0.0 111.449 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 93.1 mt -61.43 -59.83 4.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.719 0.295 . . . . 0.0 110.572 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.402 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 38.4 tt0 -55.16 -25.73 34.1 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.095 0.474 . . . . 0.0 110.052 178.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.415 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 4.3 mt-30 -69.46 -45.0 70.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.223 179.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.754 HG23 ' HG3' ' A' ' 50' ' ' GLN . 90.4 mt -64.16 -61.13 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.712 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.46 124.53 0.01 OUTLIER Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.008 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 150.65 165.17 12.48 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.914 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -58.13 -22.27 50.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.863 0.363 . . . . 0.0 110.76 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.692 ' HD3' HG23 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -74.06 -36.67 64.37 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.895 -179.693 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.692 HG23 ' HD3' ' A' ' 84' ' ' ARG . 13.7 t -70.77 -28.59 34.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.013 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 86' ' ' ARG . 18.1 tpt85 -51.39 -29.52 15.96 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.215 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.12 -31.21 23.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.098 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.47 -56.66 12.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.592 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.515 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 3.2 ppp? -64.21 -24.87 67.83 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.563 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.433 ' N ' ' SD ' ' A' ' 89' ' ' MET . 6.0 mm-40 -68.8 -31.22 70.07 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 1.8 tmtp? -71.53 -37.24 71.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.358 179.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.589 HD21 ' O ' ' A' ' 100' ' ' ALA . 0.1 OUTLIER -82.2 -26.87 32.97 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.63 -26.32 66.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.192 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -80.17 -26.81 39.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.719 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.8 p -109.96 19.24 19.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.576 178.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.521 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -52.93 111.71 1.82 Allowed Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.276 -0.874 . . . . 0.0 113.101 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.2 t -142.85 130.85 21.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.838 0.352 . . . . 0.0 110.873 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.44 -126.6 35.89 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.729 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -80.58 -29.84 36.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.882 0.372 . . . . 0.0 110.855 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.589 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.57 -34.7 38.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.677 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.521 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 42.4 ttt180 -72.04 -56.68 5.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.738 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -45.95 -23.15 0.26 Allowed 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.769 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 53.9 t -69.92 -57.66 7.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.593 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.515 ' HB1' ' HB2' ' A' ' 89' ' ' MET . . . -59.47 -55.27 36.75 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.519 HG13 ' N ' ' A' ' 106' ' ' ASN . 7.0 p -62.64 -55.72 22.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.519 ' N ' HG13 ' A' ' 105' ' ' VAL . 27.1 t-20 -56.95 -31.23 64.77 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -178.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.416 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 7.0 t80 -60.4 -33.4 72.43 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.103 0.478 . . . . 0.0 110.635 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -54.38 -13.3 0.87 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.788 -179.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -54.2 -20.68 7.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.202 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.6 p -110.82 -69.64 0.86 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.351 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 60.9 m80 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.92 -179.929 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.767 0.318 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.61 -40.76 6.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.996 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -99.3 177.65 5.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.981 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 58.26 23.08 9.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.946 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -129.96 -170.03 2.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.855 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm 63.64 18.18 10.92 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.486 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 9.3 p-90 -135.36 7.36 3.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.82 0.343 . . . . 0.0 110.931 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.2 p -66.69 -35.7 75.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.197 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 -121.42 -36.1 3.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.989 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.652 ' HE ' ' H ' ' A' ' 11' ' ' ASP . 6.9 tpm_? -64.19 139.44 58.77 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.652 ' H ' ' HE ' ' A' ' 10' ' ' ARG . 16.9 t70 77.78 -28.25 0.17 Allowed 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.504 0.503 . . . . 0.0 111.752 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.18 154.59 4.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.043 0.449 . . . . 0.0 111.826 -179.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.3 t -156.88 -40.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.315 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.494 HG23 ' H ' ' A' ' 18' ' ' ARG . 0.9 OUTLIER -64.43 168.47 5.74 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.634 179.334 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.32 -67.97 0.82 Allowed 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.593 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.4 pt? -84.91 -39.0 18.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.349 0.499 . . . . 0.0 112.349 -178.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.467 ' HB3' HG21 ' A' ' 14' ' ' THR . 38.9 t -54.89 -51.77 64.97 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.101 -0.24 . . . . 0.0 110.947 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.494 ' H ' HG23 ' A' ' 14' ' ' THR . 99.1 mtt180 -151.92 114.8 4.65 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.996 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.444 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -128.46 -43.52 1.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.768 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 97.11 74.9 1.21 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.829 -0.7 . . . . 0.0 113.05 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 62.17 8.65 2.76 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 179.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -101.12 -44.69 5.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.922 0.391 . . . . 0.0 110.804 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.469 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . -106.44 9.98 31.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.831 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.427 ' O ' ' HB3' ' A' ' 27' ' ' LEU . 3.8 t80 -61.62 -42.15 98.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.016 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -59.4 -54.55 54.94 Favored Pre-proline 0 C--N 1.33 -0.279 0 C-N-CA 120.629 -0.429 . . . . 0.0 111.384 -179.585 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 52.2 Cg_exo -48.28 -26.39 8.28 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.886 1.724 . . . . 0.0 110.86 178.714 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.538 HD21 HG13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -80.14 -36.41 35.26 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.618 179.472 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.717 HD12 HD12 ' A' ' 31' ' ' LEU . 9.4 tp -76.99 -24.61 52.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.446 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -68.94 -42.66 76.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.897 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.6 m -66.56 -12.87 59.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.569 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.717 HD12 HD12 ' A' ' 28' ' ' LEU . 81.1 mt -68.9 -7.16 32.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.687 0.28 . . . . 0.0 111.252 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.2 p -110.16 8.04 23.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.035 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.52 HD21 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -67.58 150.32 48.95 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.923 -179.839 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -64.12 -31.16 72.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.325 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.27 152.27 36.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.075 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 13.4 p90 -100.61 -33.33 10.35 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.161 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -58.79 -50.91 72.18 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.428 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.456 ' HB ' ' OD1' ' A' ' 33' ' ' ASN . 77.8 mt -63.22 -39.76 86.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.368 179.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.535 ' CZ ' HG11 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -62.3 -23.47 66.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.158 179.504 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.09 -59.61 4.57 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.032 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.6 -36.17 4.54 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.829 0.347 . . . . 0.0 110.78 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.409 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.53 -48.97 79.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.261 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.428 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -66.19 -30.64 71.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.042 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.0 m95 -68.31 -32.44 72.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.506 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.5 mt -98.93 -19.88 5.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.784 0.326 . . . . 0.0 111.528 -179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.538 HG13 HD21 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -60.35 -40.25 83.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.866 -178.908 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.07 -23.35 78.11 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.639 -0.791 . . . . 0.0 113.078 -179.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -70.75 2.08 4.62 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -101.22 -28.15 12.82 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.679 -0.237 . . . . 0.0 111.539 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.458 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.3 OUTLIER 57.26 31.48 20.17 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.117 0.484 . . . . 0.0 110.897 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -102.55 162.69 12.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.137 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -61.76 -33.49 74.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 110.574 179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.502 ' NE ' HD22 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -68.24 -16.68 64.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.354 179.721 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -96.75 -5.83 37.66 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.664 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.15 -46.29 34.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.535 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.531 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 34.6 tt0 -60.37 -50.4 85.97 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.531 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 95.0 Cg_exo -44.15 -53.85 4.38 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.549 2.166 . . . . 0.0 113.016 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.656 HD13 HD22 ' A' ' 77' ' ' LEU . 9.6 mt -54.5 -37.64 65.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.442 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.1 mm -59.67 -61.04 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -70.62 -12.21 61.42 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.782 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -89.39 -41.53 12.06 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -177.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.79 HD13 HD22 ' A' ' 92' ' ' LEU . 12.3 mt -64.49 -9.89 21.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.115 0.483 . . . . 0.0 110.997 -178.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -116.18 -12.11 11.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.703 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.471 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -61.27 -32.91 72.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.346 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.563 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 17.8 m-20 59.13 29.35 18.89 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.301 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.484 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 11.8 m -79.81 10.09 4.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.728 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 67.84 -82.29 0.17 Allowed Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.427 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.17 -48.79 78.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.021 0.438 . . . . 0.0 110.156 179.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.782 HG12 ' HG ' ' A' ' 61' ' ' LEU . 2.1 t -72.67 -44.26 60.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.675 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.563 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 3.7 tmm_? -59.03 -48.34 81.96 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.849 0.357 . . . . 0.0 110.444 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.415 ' HB3' HH12 ' A' ' 75' ' ' ARG . 72.7 m -67.1 -36.77 82.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.787 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.05 -30.0 60.07 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.676 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.423 ' O ' HD23 ' A' ' 77' ' ' LEU . . . -80.73 -40.23 25.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.646 0.26 . . . . 0.0 110.846 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.514 ' HA ' HG11 ' A' ' 103' ' ' VAL . . . -49.83 -45.36 50.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.732 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.415 HH12 ' HB3' ' A' ' 71' ' ' SER . 3.7 ptp85 -72.24 -25.61 61.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.579 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.421 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 41.9 m -67.19 -35.54 79.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.763 -179.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.77 HD21 HD11 ' A' ' 62' ' ' LEU . 4.0 mm? -55.55 -59.95 4.11 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.837 0.351 . . . . 0.0 110.724 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -64.18 -25.76 68.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.968 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.421 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 11.8 mt-30 -61.54 -43.98 97.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.212 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.458 HG12 ' HG3' ' A' ' 50' ' ' GLN . 64.8 mt -70.22 -60.86 2.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.271 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.417 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 66.59 108.37 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.788 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.504 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 152.29 -176.26 30.62 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.653 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -71.55 -31.85 67.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.339 . . . . 0.0 110.971 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.567 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.09 -54.03 49.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.869 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.567 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 9.3 p -70.65 -24.42 25.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.135 0.493 . . . . 0.0 110.816 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -57.31 -26.82 61.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.118 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.27 -26.93 47.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.987 0.422 . . . . 0.0 110.674 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.25 -46.56 60.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.305 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.495 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.92 -33.66 70.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.867 0.365 . . . . 0.0 110.566 179.837 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.4 -41.34 98.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.428 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -70.72 -24.49 62.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.025 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.79 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -84.86 -30.08 24.76 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.08 67.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.619 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.33 -25.78 39.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.343 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.3 p -117.1 21.39 13.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.33 179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -55.52 119.77 15.31 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 114.946 -1.024 . . . . 0.0 113.46 -178.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 29.8 m -139.76 129.87 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.556 -0.322 . . . . 0.0 110.361 179.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.73 -143.47 48.65 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.757 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -63.9 -30.34 71.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.756 0.312 . . . . 0.0 111.527 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.599 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -54.15 -34.38 60.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.117 -179.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.411 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 60.3 ttt180 -70.86 -58.95 3.09 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.59 ' HG3' ' ND2' ' A' ' 106' ' ' ASN . 20.9 ttmm -45.84 -25.45 0.52 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.171 0.51 . . . . 0.0 111.082 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.514 HG11 ' HA ' ' A' ' 74' ' ' ALA . 37.7 t -67.41 -48.29 77.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.375 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.619 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -64.85 -59.31 4.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.567 0.699 . . . . 0.0 112.251 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.463 ' H ' HG22 ' A' ' 105' ' ' VAL . 0.0 OUTLIER -59.39 -63.01 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 114.731 -1.122 . . . . 0.0 113.973 -177.955 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.59 ' ND2' ' HG3' ' A' ' 102' ' ' LYS . 16.0 m-80 -55.53 -25.59 38.37 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.417 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 2.1 t80 -59.0 -35.85 73.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.039 0.447 . . . . 0.0 109.927 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 46.3 mt -52.57 -22.53 5.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.717 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -64.25 -6.29 6.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.541 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.2 m -117.12 -47.6 2.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.742 0.306 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 85.8 m-70 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.93 179.701 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.0 mtt . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.615 0.245 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.46 -83.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.574 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -110.19 -174.76 2.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.812 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 61.8 -83.87 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.206 179.879 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -78.84 98.16 6.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.862 0.363 . . . . 0.0 110.806 -179.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.478 ' NZ ' ' HB2' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -158.31 -23.92 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.784 179.825 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.568 ' HA ' ' HG3' ' A' ' 10' ' ' ARG . 36.9 p-90 -88.03 16.5 5.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.763 179.668 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.409 ' O ' HG12 ' A' ' 8' ' ' VAL . 45.7 t -96.72 -9.16 9.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.182 -179.838 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.653 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 38.8 mtt180 -129.49 15.19 6.04 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.561 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.568 ' HG3' ' HA ' ' A' ' 7' ' ' TRP . 96.4 mtt180 -63.26 103.89 0.54 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.332 -1.359 . . . . 0.0 107.332 177.468 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 64.63 31.27 12.24 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -176.978 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.653 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 3.6 p -40.07 143.88 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.338 -179.448 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 t -177.32 -85.92 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.962 -178.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 70.2 p -98.13 101.56 13.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.013 179.318 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.455 ' HA ' ' HG3' ' A' ' 19' ' ' MET . . . -88.29 -68.62 0.75 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.301 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.47 ' HA ' ' HB1' ' A' ' 23' ' ' ALA . 1.8 pt? -60.28 -13.84 14.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.705 -178.703 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.6 t -67.46 -50.61 58.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.681 0.277 . . . . 0.0 110.867 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -171.13 93.22 0.17 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.252 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.455 ' HG3' ' HA ' ' A' ' 15' ' ' ALA . 20.1 mmt -133.48 -43.5 0.84 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.155 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 88.73 -34.49 3.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.525 -179.771 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -141.14 -40.04 0.4 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.794 0.33 . . . . 0.0 110.819 -179.975 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -68.34 -6.95 27.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.783 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.47 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -104.75 -10.55 17.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.27 -179.795 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.415 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.7 t80 -61.87 -48.76 79.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.595 179.582 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.4 -55.29 36.76 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.735 179.644 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 40.4 Cg_exo -50.56 -21.33 7.54 Favored 'Trans proline' 0 C--N 1.359 1.106 0 C-N-CA 121.838 1.692 . . . . 0.0 110.432 179.058 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.63 HD21 HG13 ' A' ' 46' ' ' ILE . 1.3 tp -86.32 -38.11 17.82 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.138 -1.392 . . . . 0.0 109.966 179.768 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.696 HD12 HD12 ' A' ' 31' ' ' LEU . 15.1 tp -74.58 -21.89 59.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.41 179.208 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.53 -35.23 75.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.878 -179.717 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.0 m -63.71 -24.48 67.79 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.514 -179.665 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.696 HD12 HD12 ' A' ' 28' ' ' LEU . 90.1 mt -67.46 -16.59 64.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.12 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.4 m -100.27 12.16 37.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.793 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -85.36 144.19 28.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.057 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -67.53 -29.42 68.82 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.035 -179.921 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -75.93 144.92 40.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.055 -179.831 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.516 ' HB2' HG21 ' A' ' 69' ' ' VAL . 58.1 p-90 -89.39 -31.93 17.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.748 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.413 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 4.9 tmt_? -58.96 -35.43 73.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.654 179.616 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.1 mm -82.74 -47.02 18.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.542 -179.944 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.514 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 51.3 ttp180 -57.43 -42.07 81.67 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.772 -179.273 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -55.95 -63.08 5.62 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.739 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.7 -25.98 0.84 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.65 0.262 . . . . 0.0 111.596 -179.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 39' ' ' ARG . . . -64.11 -57.0 10.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.794 0.33 . . . . 0.0 110.397 179.529 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.95 -24.95 68.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.499 179.475 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.422 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 8.1 m95 -61.2 -44.91 96.54 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.154 -179.489 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.483 ' HA ' HD22 ' A' ' 48' ' ' ASN . 27.8 mm -98.78 -19.05 6.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -178.886 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.63 HG13 HD21 ' A' ' 27' ' ' LEU . 5.8 tt -56.43 -34.25 40.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -178.499 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.42 -19.02 79.73 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.567 -0.825 . . . . 0.0 113.184 -179.277 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.483 HD22 ' HA ' ' A' ' 45' ' ' ILE . 28.9 m-80 -70.87 2.39 4.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.376 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -107.06 -18.43 13.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -179.545 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.677 ' HG3' HG23 ' A' ' 80' ' ' ILE . 1.0 OUTLIER 55.97 56.54 5.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.807 0.336 . . . . 0.0 111.249 -179.679 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -127.61 161.16 29.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.023 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.433 ' HA ' HG23 ' A' ' 55' ' ' VAL . 13.1 pt-20 -65.86 -30.6 71.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.692 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.54 ' HD3' HD22 ' A' ' 28' ' ' LEU . 17.2 ttm180 -69.17 -10.89 59.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.69 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.415 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -106.3 3.17 27.34 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.066 -179.557 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.569 HG22 HH12 ' A' ' 84' ' ' ARG . 64.5 t -83.2 -55.09 7.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.173 -178.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.487 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 18.9 tt0 -59.17 -49.01 95.26 Favored Pre-proline 0 CA--C 1.532 0.271 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.69 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.487 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 90.4 Cg_exo -42.94 -32.33 2.63 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.484 2.123 . . . . 0.0 112.732 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.685 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 4.8 mt -73.35 -52.71 12.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.736 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 38.5 mm -49.25 -50.75 15.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.968 -179.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.99 -32.85 71.26 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -178.629 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.535 ' HG ' HG12 ' A' ' 69' ' ' VAL . 5.2 tp -89.82 -12.41 39.21 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.895 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.594 HD13 HD22 ' A' ' 92' ' ' LEU . 17.0 mt -72.97 -13.84 61.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.881 0.372 . . . . 0.0 111.1 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -116.03 9.78 14.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.101 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.07 -31.75 71.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.265 0.555 . . . . 0.0 110.931 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 23.3 m-20 51.9 25.14 2.88 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.237 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.9 t -86.22 -17.15 35.54 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.758 0.314 . . . . 0.0 110.825 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.76 -110.22 1.6 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.311 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.422 ' HD1' ' NE1' ' A' ' 44' ' ' TRP . 0.1 OUTLIER -60.33 -26.58 66.68 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.469 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.535 HG12 ' HG ' ' A' ' 61' ' ' LEU . 24.3 t -69.46 -30.04 44.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.628 178.685 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.463 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 57.5 ttp180 -78.38 -55.74 5.0 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.464 179.391 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.469 ' O ' ' HG3' ' A' ' 75' ' ' ARG . 46.2 m -62.37 -28.0 69.47 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.967 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.5 -59.98 9.79 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.583 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.685 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -60.68 -27.94 68.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.786 0.327 . . . . 0.0 110.911 179.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.549 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.9 -45.15 95.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.573 -179.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.519 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 28.5 mtp85 -62.2 -33.47 74.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.412 -179.578 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.8 m -50.74 -46.48 59.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.846 -178.358 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.612 ' H ' HD12 ' A' ' 77' ' ' LEU . 5.7 mp -56.96 -55.76 30.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.844 0.354 . . . . 0.0 110.133 179.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -59.1 -32.76 70.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.281 179.139 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 29.6 mt-30 -65.32 -30.74 71.62 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.803 0.335 . . . . 0.0 110.776 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.677 HG23 ' HG3' ' A' ' 50' ' ' GLN . 90.1 mt -90.06 -60.88 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.3 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.51 113.66 0.01 OUTLIER Glycine 0 C--N 1.331 0.27 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.016 179.754 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.03 174.89 30.39 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.629 179.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.3 -32.77 74.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.809 0.338 . . . . 0.0 111.004 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.698 HH11 HG13 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -61.48 -54.85 37.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.469 179.948 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.698 HG13 HH11 ' A' ' 84' ' ' ARG . 0.0 OUTLIER -70.72 -21.62 22.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.834 179.213 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -56.44 -27.79 57.68 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.712 179.921 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -78.62 -27.55 45.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.241 179.69 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.69 -47.08 79.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.666 179.497 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.499 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 3.0 ppp? -67.57 -25.91 66.02 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.76 0.314 . . . . 0.0 110.215 179.735 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.442 ' N ' ' SD ' ' A' ' 89' ' ' MET . 37.0 mt-10 -69.03 -39.27 79.32 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.707 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -69.46 -31.2 69.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.908 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.594 HD22 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -85.73 -24.29 26.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.096 -179.945 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.99 -28.76 70.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.68 179.391 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -80.34 -25.01 39.46 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.048 0.451 . . . . 0.0 110.011 179.627 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.0 p -111.99 17.48 19.63 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.393 179.215 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.436 ' HA3' ' CD ' ' A' ' 101' ' ' ARG . . . -55.76 121.5 23.4 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.887 -179.346 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.6 t -139.81 130.11 25.32 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.432 -0.384 . . . . 0.0 111.267 179.455 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 51.58 -113.23 2.24 Favored Glycine 0 C--N 1.33 0.215 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.743 179.893 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.473 ' O ' HG23 ' A' ' 103' ' ' VAL . 70.7 t80 -78.71 -33.32 46.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.756 0.312 . . . . 0.0 110.91 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.482 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -53.57 -39.46 64.83 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.61 -179.929 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.436 ' CD ' ' HA3' ' A' ' 96' ' ' GLY . 8.5 tpt180 -66.66 -61.28 2.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.677 0.275 . . . . 0.0 111.341 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -48.26 -26.78 2.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.884 -179.664 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.482 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 8.5 t -61.13 -52.7 58.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.022 179.53 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.499 ' HB1' ' HB2' ' A' ' 89' ' ' MET . . . -64.84 -59.81 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.124 -179.475 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 52.1 t -52.58 -63.03 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.934 -178.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -56.03 -33.94 65.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -178.844 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -61.08 -25.57 67.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.028 0.442 . . . . 0.0 111.067 -179.398 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.448 HD11 ' HE1' ' A' ' 89' ' ' MET . 81.1 mt -57.89 -21.53 43.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.735 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -96.29 7.04 47.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.77 -179.16 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 66.8 p -119.97 -16.46 8.63 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -179.125 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.427 ' HD2' ' HA ' ' A' ' 108' ' ' LEU . 7.9 p80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.066 -0.969 . . . . 0.0 110.81 -179.746 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptp . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 120.612 0.244 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.34 101.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.899 -179.656 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.2 t70 68.87 -2.75 1.63 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.962 -179.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -128.63 95.44 4.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.753 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 61.12 107.51 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.326 179.966 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -127.41 -15.53 5.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.602 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 19.7 p-90 -140.04 25.4 2.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.641 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.467 HG23 ' HG2' ' A' ' 22' ' ' GLU . 9.1 p -73.67 11.52 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.27 -179.744 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.573 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 73.3 ttt180 -154.05 -3.24 0.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.914 179.749 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -60.88 104.83 0.4 Allowed 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.601 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.6 t70 65.84 34.36 7.37 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -177.475 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.573 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 7.6 p -42.33 154.9 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.523 -179.195 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.423 ' N ' HG22 ' A' ' 12' ' ' VAL . 9.7 t -159.39 -158.38 0.66 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.858 -178.629 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.55 ' HB ' ' HB3' ' A' ' 17' ' ' SER . 1.6 m -52.34 170.62 0.06 Allowed 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.566 179.654 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.544 ' H ' HG22 ' A' ' 14' ' ' THR . . . -82.08 -68.65 0.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -178.415 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.489 ' C ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -86.36 -13.3 46.85 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -178.164 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.55 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 47.3 t -51.78 -53.53 38.84 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.559 -178.916 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' A' ' 17' ' ' SER . 42.9 ttt180 174.37 96.64 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.114 0.259 . . . . 0.0 111.574 179.729 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 22.8 mtm -134.23 -9.63 2.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.827 0.346 . . . . 0.0 110.901 179.07 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 85.32 -114.86 4.04 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.462 179.982 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -66.97 -24.03 66.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.953 0.406 . . . . 0.0 110.888 179.959 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' HG2' HG23 ' A' ' 8' ' ' VAL . 6.8 mt-10 -82.23 -24.59 34.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.918 -179.544 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.407 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . -95.57 -11.53 27.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.582 -179.568 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.589 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 1.2 t80 -63.26 -44.64 94.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.038 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -63.35 -56.17 29.49 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.407 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 89.5 Cg_exo -45.15 -26.85 2.5 Favored 'Trans proline' 0 C--N 1.358 1.052 0 C-N-CA 122.022 1.815 . . . . 0.0 111.269 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 66.3 mt -71.21 -55.92 7.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.142 -0.936 . . . . 0.0 109.51 178.3 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.569 HD12 HD12 ' A' ' 31' ' ' LEU . 14.8 tp -63.64 -18.49 64.0 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.95 178.814 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -82.91 -30.17 28.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.66 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.474 ' OG ' HG22 ' A' ' 38' ' ' ILE . 44.2 t -65.09 -17.16 64.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.995 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.657 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 89.1 mt -66.28 -20.88 66.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.941 179.978 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.2 m -89.78 19.17 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.605 179.502 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -101.48 131.6 47.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.053 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -66.87 -11.32 55.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.469 -179.658 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -86.38 133.42 33.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.903 0.383 . . . . 0.0 111.329 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 53.8 p-90 -79.03 -32.1 44.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.366 179.423 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -64.97 -50.43 66.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.14 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.474 HG22 ' OG ' ' A' ' 30' ' ' SER . 71.5 mt -66.94 -51.7 51.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.228 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.657 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 32.1 ttm180 -58.59 -24.62 61.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.815 0.341 . . . . 0.0 110.707 -179.944 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.27 -57.55 7.43 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.48 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.17 -37.86 36.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.658 0.266 . . . . 0.0 111.415 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.63 -52.69 64.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.911 0.386 . . . . 0.0 110.758 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.446 ' HB2' HD21 ' A' ' 61' ' ' LEU . . . -66.07 -33.55 76.05 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.12 179.588 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -66.3 -28.92 69.06 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.432 -178.827 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 53.5 mt -100.09 -27.14 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.849 0.357 . . . . 0.0 111.567 -179.026 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.445 HD12 ' HB3' ' A' ' 27' ' ' LEU . 1.1 tt -58.39 -30.95 41.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.023 -178.943 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -68.38 -21.24 74.12 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.513 -179.299 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -70.57 -25.21 62.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.888 0.344 . . . . 0.0 111.9 -179.318 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -69.68 -35.22 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -179.45 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.62 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 41.3 mt-30 64.99 17.62 11.16 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.058 0.456 . . . . 0.0 110.354 -179.964 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -89.56 164.08 14.93 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.236 -179.702 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -62.9 -36.74 84.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.079 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -68.23 -9.21 45.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.712 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.434 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -102.6 -1.77 29.67 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.479 -179.615 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.6 t -87.57 -35.08 7.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.15 -179.761 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.535 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 1.6 tm-20 -60.41 -49.6 89.58 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.504 -179.679 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.535 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 71.7 Cg_exo -48.19 -50.48 11.94 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.041 1.827 . . . . 0.0 111.993 179.548 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 73' ' ' ALA . 11.0 mt -57.86 -30.22 65.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.777 -179.381 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 31.4 mm -62.43 -59.1 4.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -70.08 -36.09 74.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.744 0.307 . . . . 0.0 111.485 -179.423 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.671 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -54.6 -55.42 29.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.171 -179.176 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.725 HD13 HD22 ' A' ' 92' ' ' LEU . 16.7 mt -53.91 -12.25 0.54 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.721 0.296 . . . . 0.0 111.188 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -114.29 -15.46 12.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.375 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.1 -41.2 96.25 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.329 0.585 . . . . 0.0 111.256 -179.281 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.664 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 24.1 t70 61.11 28.25 17.97 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.778 -179.845 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.506 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 56.4 m -82.14 1.11 37.74 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.119 -179.334 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.59 -86.78 1.54 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.528 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -62.65 -44.06 97.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.04 0.448 . . . . 0.0 110.26 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.671 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.8 t -71.2 -39.93 73.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.158 -179.896 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.664 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 5.2 ttm180 -68.29 -62.27 1.47 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.688 179.987 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.8 t -53.7 -26.43 22.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.802 179.561 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -57.34 -46.87 91.34 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.933 179.596 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.452 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -66.93 -28.58 68.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.702 0.286 . . . . 0.0 110.976 179.516 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.58 -43.89 96.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.815 -179.701 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 3.8 ptp180 -83.05 -37.08 24.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.826 179.808 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.6 m -53.22 -41.31 65.22 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.099 179.887 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 73' ' ' ALA . 78.4 mt -55.4 -59.32 4.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.888 0.375 . . . . 0.0 110.138 179.049 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -51.88 -32.65 33.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.811 178.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 75' ' ' ARG . 23.9 mt-30 -66.42 -31.09 71.64 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-O 120.945 0.402 . . . . 0.0 110.366 179.652 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.62 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 90.6 mt -75.91 -61.54 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.464 -179.721 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 57.81 110.63 0.01 OUTLIER Glycine 0 CA--C 1.52 0.389 0 C-N-CA 120.995 -0.622 . . . . 0.0 113.157 179.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 150.82 -165.65 30.2 Favored Glycine 0 C--N 1.33 0.25 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.723 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.577 ' HG3' HH21 ' A' ' 86' ' ' ARG . 1.9 mp0 -72.21 -40.59 67.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.94 0.4 . . . . 0.0 110.643 179.735 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.51 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -54.75 -50.98 67.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.476 179.681 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.51 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 9.9 p -70.85 -27.12 29.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.072 179.4 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.577 HH21 ' HG3' ' A' ' 83' ' ' GLU . 7.4 ttp180 -58.66 -30.49 67.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.933 -178.764 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.63 -23.37 27.55 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.79 0.292 . . . . 0.0 111.79 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.5 -37.68 71.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.44 -179.327 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.434 ' SD ' HD23 ' A' ' 108' ' ' LEU . 9.8 ptt? -72.0 -36.7 69.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.55 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -68.38 -45.27 73.18 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.502 179.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -60.82 -24.92 66.22 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.708 179.576 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.725 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -86.45 -33.84 20.28 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.403 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.68 -15.23 57.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.062 179.822 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -84.37 -30.3 25.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.94 179.522 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.5 p -119.82 21.56 11.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.394 179.415 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -50.72 127.0 26.71 Favored Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 114.923 -1.035 . . . . 0.0 113.612 -178.896 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 t -144.22 130.17 19.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.426 -0.387 . . . . 0.0 110.751 179.015 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 57.89 -152.31 28.06 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.758 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.468 ' HB3' HH12 ' A' ' 70' ' ' ARG . 49.9 t80 -52.77 -33.13 47.21 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.655 0.264 . . . . 0.0 111.348 -179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.604 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -52.3 -40.31 61.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.741 -179.571 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 -71.78 -52.84 15.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.604 -179.597 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -45.61 -26.48 0.61 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.244 0.545 . . . . 0.0 110.51 -179.79 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 99' ' ' PHE . 45.6 t -66.93 -57.81 8.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.46 179.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.607 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -54.62 -62.17 1.83 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.943 0.719 . . . . 0.0 112.943 -179.135 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.684 HG13 HD22 ' A' ' 106' ' ' ASN . 7.5 p -53.88 -47.1 64.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.721 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.684 HD22 HG13 ' A' ' 105' ' ' VAL . 0.9 OUTLIER -70.79 -35.55 72.61 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.271 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -64.9 -26.18 68.21 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 120.817 0.341 . . . . 0.0 111.385 -178.238 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.434 HD23 ' SD ' ' A' ' 89' ' ' MET . 39.7 mt -49.98 -26.65 4.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.295 179.715 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.53 -6.2 0.67 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.226 -179.399 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 p -114.8 -74.23 0.62 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 13.0 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.916 -179.834 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.6 tpt . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.809 0.338 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.06 141.49 45.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.096 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.7 t70 62.49 177.58 0.14 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.965 179.849 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 65.41 14.77 9.66 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.043 179.681 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.491 ' ND2' HG12 ' A' ' 8' ' ' VAL . 2.4 t-20 -126.96 29.01 5.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.79 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -58.8 -46.71 86.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.008 0.432 . . . . 0.0 110.001 179.414 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -105.12 90.06 3.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.73 179.142 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.491 HG12 ' ND2' ' A' ' 5' ' ' ASN . 1.5 m -84.77 -28.3 6.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.836 -178.713 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.4 tpp180 -114.32 -54.93 2.55 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.003 -179.821 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.458 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 1.7 mpp_? -47.65 112.95 0.62 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 178.965 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.458 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 20.4 t70 75.76 90.73 0.08 Allowed 'General case' 0 C--O 1.231 0.131 0 O-C-N 123.656 0.597 . . . . 0.0 110.413 -178.896 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.75 HG22 ' H ' ' A' ' 13' ' ' SER . 3.5 p -171.42 -177.22 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.656 -179.526 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.75 ' H ' HG22 ' A' ' 12' ' ' VAL . 32.6 t 68.98 11.51 8.36 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.001 0.429 . . . . 0.0 111.139 179.53 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.9 t -170.82 -11.77 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.277 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.79 -0.06 57.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.072 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.612 ' H ' HD12 ' A' ' 16' ' ' LEU . 4.8 mp -44.06 -20.94 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.232 -179.291 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 38.7 t -48.32 -32.92 8.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.518 0.199 . . . . 0.0 111.357 179.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -178.21 90.46 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.861 -179.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.486 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 1.6 mmt -133.4 -44.33 0.84 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.663 -179.923 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 120.71 -116.58 3.24 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.346 -0.93 . . . . 0.0 113.34 179.864 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -90.2 -23.2 21.35 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.08 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.486 ' HG2' ' HB3' ' A' ' 19' ' ' MET . 10.9 pt-20 -66.97 -23.5 65.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.923 0.392 . . . . 0.0 110.385 179.963 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.471 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -103.65 6.92 37.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.709 179.522 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.506 ' CE2' ' HB3' ' A' ' 53' ' ' ARG . 1.1 t80 -59.15 -53.17 61.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.515 179.453 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.453 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 4.2 mm-40 -63.51 -57.13 21.21 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.629 179.106 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HB2' HD21 ' A' ' 16' ' ' LEU . 32.9 Cg_exo -50.06 -21.96 7.16 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 121.993 1.795 . . . . 0.0 110.892 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.671 HD21 HG13 ' A' ' 46' ' ' ILE . 1.3 tp -79.31 -42.89 24.71 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 114.632 -1.167 . . . . 0.0 109.87 179.717 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.621 HD12 HD12 ' A' ' 31' ' ' LEU . 18.5 tp -75.6 -21.06 58.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.108 178.844 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 15.4 mm-40 -76.45 -40.69 49.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.519 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.403 ' O ' ' HB3' ' A' ' 33' ' ' ASN . 72.6 p -66.24 -16.29 63.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.491 -179.83 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.621 HD12 HD12 ' A' ' 28' ' ' LEU . 78.2 mt -65.71 -8.71 22.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.727 0.298 . . . . 0.0 111.129 179.955 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.4 t -95.08 8.96 41.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.733 179.71 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.632 HD21 ' HB3' ' A' ' 35' ' ' ASP . 0.8 OUTLIER -81.08 128.84 34.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.169 -179.808 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.17 -27.11 65.37 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.276 -179.084 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.632 ' HB3' HD21 ' A' ' 33' ' ' ASN . 36.7 t70 -75.85 163.0 27.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.793 0.33 . . . . 0.0 111.075 -179.59 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 13.5 p90 -107.67 -31.89 7.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.29 -179.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -59.72 -39.03 83.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.0 mt -80.52 -44.75 21.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.828 179.841 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -65.12 -19.56 66.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.741 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.76 -66.44 2.63 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.531 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -47.1 -35.78 7.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.795 0.331 . . . . 0.0 111.206 179.755 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.2 -49.45 77.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.54 179.622 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.406 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -68.12 -34.55 76.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.783 179.452 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -67.23 -27.86 67.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.012 -179.234 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.6 mt -99.16 -28.79 3.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.78 0.324 . . . . 0.0 111.617 -179.256 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.671 HG13 HD21 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -60.86 -28.7 43.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.176 -179.32 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -69.4 -24.73 75.98 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.27 179.666 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -64.68 -32.97 74.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.775 0.321 . . . . 0.0 110.463 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.469 ' C ' ' H ' ' A' ' 51' ' ' ASP . 17.8 m-85 -92.32 108.7 20.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.441 179.581 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -76.58 31.26 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.035 0.445 . . . . 0.0 111.005 179.885 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 49' ' ' PHE . 20.8 t70 -85.52 160.32 19.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.903 -179.931 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.98 -40.28 97.27 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.795 -179.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.506 ' HB3' ' CE2' ' A' ' 24' ' ' PHE . 39.6 ttm180 -65.33 -12.28 50.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.133 -179.839 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.52 ' O ' HD13 ' A' ' 58' ' ' LEU . . . -106.11 8.94 32.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.134 -179.143 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 51' ' ' ASP . 40.9 t -92.1 -41.73 13.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.213 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.515 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 5.8 tp10 -55.9 -49.17 94.49 Favored Pre-proline 0 C--N 1.331 -0.236 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.088 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.515 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 97.0 Cg_exo -44.24 -52.93 5.23 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.22 1.947 . . . . 0.0 112.055 -179.963 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 54' ' ' ALA . 6.8 mp -51.44 -40.32 59.15 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.888 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.9 mm -59.82 -60.83 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -70.06 -22.35 63.08 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -179.233 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.686 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -76.23 -44.92 35.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -177.966 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.71 ' HB3' HD11 ' A' ' 92' ' ' LEU . 31.3 mt -62.21 -9.2 7.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.117 0.484 . . . . 0.0 110.698 -179.032 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -127.38 -2.54 6.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.652 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.483 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 47.7 t0 -61.36 -33.89 74.39 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.338 -179.766 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.659 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 3.7 m-20 59.79 25.68 14.75 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.796 -179.548 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.533 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.9 m -86.29 8.65 20.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.42 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 74.31 -94.31 0.82 Allowed Glycine 0 C--N 1.333 0.361 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.701 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.66 -42.19 78.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.975 0.417 . . . . 0.0 110.502 179.892 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.686 HG12 ' HG ' ' A' ' 61' ' ' LEU . 25.7 t -71.66 -33.19 48.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.726 -179.666 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.659 ' HD2' ' HA ' ' A' ' 65' ' ' ASP . 47.6 ttt180 -73.26 -61.23 1.89 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.01 -179.934 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.2 m -51.65 -30.17 20.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.993 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.51 -43.7 95.84 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.35 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.533 ' HA ' ' HB2' ' A' ' 76' ' ' SER . . . -72.35 -34.04 67.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.795 0.331 . . . . 0.0 110.832 179.718 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.515 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -53.65 -44.11 69.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.567 179.759 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.4 ptp85 -83.02 -28.2 29.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.367 179.348 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.533 ' HB2' ' HA ' ' A' ' 73' ' ' ALA . 58.7 m -62.29 -20.98 64.86 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.189 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.567 HD21 HD11 ' A' ' 62' ' ' LEU . 4.9 mt -66.34 -61.26 2.1 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.734 0.302 . . . . 0.0 110.437 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -61.45 -22.28 64.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.761 178.685 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.511 ' HB2' ' HA ' ' A' ' 76' ' ' SER . 0.0 OUTLIER -65.74 -37.85 87.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.165 179.307 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.506 ' HB ' HG21 ' A' ' 85' ' ' VAL . 77.6 mt -87.61 -60.89 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.085 179.845 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.66 125.59 0.02 OUTLIER Glycine 0 C--N 1.331 0.258 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.847 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 147.08 -174.13 26.99 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.992 179.743 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -72.21 -22.11 61.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.939 0.4 . . . . 0.0 111.097 -179.889 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.587 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -71.18 -46.75 60.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.872 -179.935 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.55 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 12.1 t -70.73 -26.64 28.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.447 179.898 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ppt_? -58.69 -20.03 44.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.445 -179.528 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -82.29 -30.56 30.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.595 179.457 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.25 -40.32 74.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.194 179.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.502 ' O ' ' HB1' ' A' ' 104' ' ' ALA . 16.1 ptt? -71.18 -39.18 72.0 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.723 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -64.73 -26.65 68.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.988 0.423 . . . . 0.0 109.899 179.028 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -64.72 -48.01 76.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.23 179.325 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.71 HD11 ' HB3' ' A' ' 62' ' ' LEU . 54.5 mt -68.49 -35.07 77.0 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.403 179.39 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.477 ' HA ' ' CZ ' ' A' ' 101' ' ' ARG . . . -55.18 -33.56 63.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.834 179.058 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -96.99 -11.92 23.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.155 179.681 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.1 m -92.24 -28.62 16.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.951 0.405 . . . . 0.0 111.065 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 62.7 113.3 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.62 -179.642 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.619 ' H ' ' HB2' ' A' ' 101' ' ' ARG . 14.1 p -146.56 -176.58 5.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.734 0.302 . . . . 0.0 111.032 -179.533 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -83.69 -83.71 0.92 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.512 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.442 ' O ' HG23 ' A' ' 103' ' ' VAL . 58.2 t80 -78.52 -40.35 35.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.746 0.307 . . . . 0.0 111.01 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.414 ' HB3' ' OG1' ' A' ' 97' ' ' THR . . . -57.01 -43.32 81.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.651 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.619 ' HB2' ' H ' ' A' ' 97' ' ' THR . 23.8 tpt85 -59.9 -61.39 2.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.497 -179.384 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 54.2 tttt -50.13 -37.37 33.92 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.174 0.511 . . . . 0.0 110.118 179.63 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.515 HG21 ' HB1' ' A' ' 74' ' ' ALA . 11.9 t -61.5 -41.86 91.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.902 179.369 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.502 ' HB1' ' O ' ' A' ' 89' ' ' MET . . . -64.88 -59.75 3.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.139 -179.473 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.451 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 4.4 p -58.96 -47.16 90.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.819 -178.969 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.437 ' N ' HG13 ' A' ' 105' ' ' VAL . 37.0 t30 -64.67 -32.57 74.29 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.559 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -62.45 -26.92 68.77 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 120.666 0.27 . . . . 0.0 111.143 -178.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.3 mt -51.94 -26.2 9.9 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.25 179.766 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -55.35 -18.37 6.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.284 179.887 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.423 HG22 ' CD2' ' A' ' 111' ' ' HIS . 9.0 m -101.99 -74.72 0.62 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.936 -179.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.423 ' CD2' HG22 ' A' ' 110' ' ' THR . 94.3 m-70 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.69 179.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.768 0.318 . . . . 0.0 110.674 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.28 -58.76 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.045 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -140.01 -2.12 1.52 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.641 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -81.91 -62.1 1.73 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.738 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 48.8 m-20 -99.71 31.4 3.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.552 179.674 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 54.2 tttm -91.93 -24.01 19.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.226 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 34.3 p-90 -147.04 25.55 1.13 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.413 -179.748 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.404 ' HA ' ' OE2' ' A' ' 22' ' ' GLU . 2.5 p -58.41 96.04 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.142 0.496 . . . . 0.0 111.123 179.942 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.46 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 21.5 ttm180 59.94 9.04 1.59 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.312 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 31.0 mmm180 -67.11 104.43 1.42 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.951 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 9.3 m-20 69.09 12.19 8.48 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.573 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.613 HG12 ' H ' ' A' ' 14' ' ' THR . 38.3 t -89.82 -88.64 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.648 0.261 . . . . 0.0 111.164 -179.883 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.8 t 55.87 18.83 3.19 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.697 179.733 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.613 ' H ' HG12 ' A' ' 12' ' ' VAL . 9.1 t -141.33 11.54 2.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.02 0.438 . . . . 0.0 111.043 179.87 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.54 ' O ' ' HG3' ' A' ' 19' ' ' MET . . . -83.2 -0.06 47.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.468 -179.781 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -44.01 -17.71 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -178.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.425 ' N ' ' O ' ' A' ' 15' ' ' ALA . 88.2 p -60.85 -46.97 88.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.703 0.287 . . . . 0.0 110.504 178.959 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -175.97 102.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.812 179.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.54 ' HG3' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -133.08 -43.57 0.87 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.659 -179.577 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.94 6.35 89.51 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.626 -0.797 . . . . 0.0 113.012 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -175.88 -28.64 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.565 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.509 ' H ' ' HB2' ' A' ' 19' ' ' MET . 5.2 mm-40 -73.5 -43.45 60.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.369 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.432 ' HB3' ' SD ' ' A' ' 19' ' ' MET . . . -105.86 17.13 24.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -178.369 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.462 ' CE1' ' HB3' ' A' ' 53' ' ' ARG . 2.1 t80 -57.96 -51.34 70.06 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.3 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.457 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 0.4 OUTLIER -63.37 -57.8 18.56 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.231 179.508 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HD3' ' HB2' ' A' ' 25' ' ' GLU . 83.3 Cg_exo -46.57 -25.2 3.3 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 122.065 1.843 . . . . 0.0 111.467 -179.706 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 19.7 mt -77.5 -46.54 22.12 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.894 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.625 HD12 HD12 ' A' ' 31' ' ' LEU . 27.3 tp -68.47 -19.8 64.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.918 178.855 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.58 -23.82 53.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.469 179.824 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.5 m -66.39 -24.08 66.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.132 -179.675 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.625 HD12 HD12 ' A' ' 28' ' ' LEU . 85.3 mt -65.34 -10.77 35.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.842 0.353 . . . . 0.0 110.643 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.6 t -88.67 8.37 28.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.534 179.851 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -102.32 130.04 48.94 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.33 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -68.27 -4.03 12.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.966 179.366 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -77.6 150.54 34.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.734 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 46.9 m0 -88.04 -46.25 9.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.965 -179.973 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -60.29 -37.22 79.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.238 -179.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.9 mt -75.03 -57.28 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.244 -179.781 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.564 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 24.7 ttm180 -59.03 -23.22 61.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.066 -179.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.402 ' HA2' ' HA ' ' A' ' 69' ' ' VAL . . . -77.06 -59.07 3.24 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.767 -179.741 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.69 8.37 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.763 0.316 . . . . 0.0 111.502 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.82 -56.53 20.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.769 179.741 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.454 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -65.79 -35.37 80.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.833 179.359 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -55.37 -33.37 63.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.673 -179.582 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.47 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . 46.7 mm -99.5 -23.04 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.244 0.545 . . . . 0.0 110.758 -179.835 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.623 HG23 ' HB1' ' A' ' 54' ' ' ALA . 1.0 OUTLIER -60.04 -32.53 50.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.767 -179.209 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.59 -22.2 77.87 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.608 -0.806 . . . . 0.0 113.092 -179.31 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.47 ' ND2' ' HA ' ' A' ' 45' ' ' ILE . 32.1 m-80 -70.74 -8.12 49.87 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.19 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -94.97 -26.81 15.95 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.566 ' HG3' HD12 ' A' ' 80' ' ' ILE . 19.2 mp0 57.76 30.52 19.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.995 0.426 . . . . 0.0 111.005 -179.577 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.412 ' O ' HG23 ' A' ' 55' ' ' VAL . 23.6 t70 -102.43 161.02 14.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.995 -179.822 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -62.44 -37.98 88.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.066 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.462 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 17.9 ttm180 -67.09 -9.0 34.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.586 179.741 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.623 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -103.74 -9.63 18.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.86 -179.26 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 51' ' ' ASP . 68.1 t -82.91 -35.16 12.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.245 -179.827 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.607 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 26.9 tt0 -60.27 -51.37 80.72 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.778 -179.454 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.607 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 54.1 Cg_exo -52.5 -34.86 64.03 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.148 1.898 . . . . 0.0 112.595 179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.537 ' HA ' ' HB2' ' A' ' 73' ' ' ALA . 8.7 mt -72.18 -27.27 62.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.202 -179.339 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 33.3 mm -63.05 -59.75 3.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.315 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -70.03 -7.02 37.63 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -178.342 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.764 ' HG ' HG12 ' A' ' 69' ' ' VAL . 3.1 mp -89.84 -40.57 12.35 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -177.997 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.833 HD11 HD11 ' A' ' 77' ' ' LEU . 4.3 mt -59.68 -14.81 15.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.278 0.561 . . . . 0.0 110.244 -178.888 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -104.46 -27.93 11.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.441 179.136 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.46 ' O ' ' HB2' ' A' ' 70' ' ' ARG . 34.2 t70 -59.77 138.31 57.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.853 -179.765 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -110.74 39.04 2.32 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.043 -179.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 67.2 m -86.49 -30.68 21.79 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.283 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 115.54 -92.06 0.57 Allowed Glycine 0 C--N 1.329 0.175 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.032 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -57.96 -31.55 66.99 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.191 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.764 HG12 ' HG ' ' A' ' 61' ' ' LEU . 22.7 t -69.16 -51.2 45.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.05 179.829 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 57.9 ttp180 -61.02 -58.59 7.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.641 -179.816 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 63.9 m -51.05 -27.09 7.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.867 -179.043 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.61 -56.04 26.73 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.292 179.902 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.537 ' HB2' ' HA ' ' A' ' 58' ' ' LEU . . . -60.2 -38.66 83.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.909 0.336 . . . . 0.0 111.909 179.767 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.05 -44.42 67.42 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -178.71 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.46 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 7.7 ptp180 -84.57 -35.42 22.81 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.269 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.523 ' HA ' HE21 ' A' ' 79' ' ' GLN . 67.4 m -63.39 -36.05 82.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.048 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.833 HD11 HD11 ' A' ' 62' ' ' LEU . 34.5 mt -61.76 -61.07 2.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.571 0.224 . . . . 0.0 111.221 -179.902 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.434 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 38.1 tt0 -62.25 -19.9 63.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.049 0.452 . . . . 0.0 110.395 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.523 HE21 ' HA ' ' A' ' 76' ' ' SER . 8.2 tt0 -62.83 -25.22 68.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.498 179.668 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.566 HD12 ' HG3' ' A' ' 50' ' ' GLN . 2.5 mm -90.79 -60.14 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.056 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.03 98.27 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.775 -0.648 . . . . 0.0 112.46 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 169.35 -174.15 43.73 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.46 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -70.93 -23.85 62.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.736 0.303 . . . . 0.0 110.673 -179.856 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.504 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -62.7 -53.16 58.72 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.646 179.866 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.697 HG13 HD22 ' A' ' 77' ' ' LEU . 93.6 t -70.65 -24.69 25.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.943 0.401 . . . . 0.0 110.692 179.217 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.3 -27.48 35.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.615 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.86 -30.21 23.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.442 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.13 -38.85 72.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.242 179.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.818 ' HE2' HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -68.64 -32.84 72.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.671 179.434 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -64.9 -42.51 94.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.316 179.3 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -58.73 -38.17 77.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.084 179.793 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.644 HD22 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -86.54 -23.11 25.97 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.462 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.27 -21.32 62.11 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.528 179.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.47 -26.03 38.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.684 179.591 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 82.4 p -119.59 22.93 11.44 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.248 178.775 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -54.38 123.3 27.48 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.009 -0.996 . . . . 0.0 113.594 -178.781 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.0 t -145.95 130.04 17.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.46 -0.37 . . . . 0.0 110.684 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 58.09 -139.07 47.99 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.066 -0.588 . . . . 0.0 112.879 -179.76 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -60.8 -31.55 70.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.811 0.338 . . . . 0.0 111.088 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.578 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -54.1 -42.52 69.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.913 -179.404 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -67.11 -58.49 4.78 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -178.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.0 ttmp? -45.52 -30.04 1.33 Allowed 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.046 0.451 . . . . 0.0 110.885 -179.497 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.477 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 12.2 t -60.24 -57.08 13.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.236 179.511 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.624 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -63.74 -53.59 48.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.283 -179.194 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.8 t -61.28 -62.01 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -178.195 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -55.61 -29.4 59.08 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -178.124 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.434 ' CE1' ' HA ' ' A' ' 78' ' ' GLU . 3.0 t80 -58.84 -32.96 69.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.927 0.394 . . . . 0.0 110.635 -179.479 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.818 HD11 ' HE2' ' A' ' 89' ' ' MET . 37.6 mt -55.28 -23.44 23.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.606 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.98 6.66 8.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.599 -179.826 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.7 m -126.44 -74.93 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.428 -179.863 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.579 -179.959 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ppp? . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.723 0.297 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.32 131.82 51.97 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.029 -179.978 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 57.87 -90.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.897 -179.562 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -172.57 55.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.91 0.386 . . . . 0.0 110.956 179.803 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 57.27 20.89 6.14 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.391 179.555 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' HB3' HH11 ' A' ' 10' ' ' ARG . 67.6 mttm -89.92 43.98 1.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.087 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 53.5 p-90 -148.15 20.9 1.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.393 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.9 p -90.88 85.03 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.293 0.568 . . . . 0.0 111.184 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.439 ' N ' ' HB3' ' A' ' 22' ' ' GLU . 53.9 ttp180 68.89 6.08 5.38 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.525 179.5 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 48.3 ttt180 -79.27 107.12 11.8 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.241 178.477 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.457 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 21.5 t70 73.59 -3.95 2.35 Favored 'General case' 0 N--CA 1.463 0.183 0 O-C-N 123.543 0.527 . . . . 0.0 111.035 -179.531 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.877 HG13 ' HB3' ' A' ' 15' ' ' ALA . 76.4 t -59.24 -85.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.274 -179.633 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.405 ' N ' HG12 ' A' ' 12' ' ' VAL . 46.7 t 55.37 -88.25 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.675 0.274 . . . . 0.0 111.475 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.3 p -95.73 14.02 24.55 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.39 -179.736 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.877 ' HB3' HG13 ' A' ' 12' ' ' VAL . . . -72.51 -1.69 16.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.89 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 pp -50.75 -12.65 0.11 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.749 179.632 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.7 t -45.52 -23.59 0.24 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.268 0.469 . . . . 0.0 112.268 -179.691 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 55.9 ttp180 -162.74 -61.54 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 179.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 21.3 ptm -48.83 -43.19 38.3 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 51.47 -154.26 4.47 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.747 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.511 ' H ' ' HE2' ' A' ' 49' ' ' PHE . 11.2 m-20 64.31 -73.78 0.05 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.95 0.405 . . . . 0.0 110.73 -179.54 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' HB2' HG11 ' A' ' 12' ' ' VAL . 4.3 mm-40 -63.48 -18.14 63.47 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.214 179.415 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.43 5.9 32.05 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.378 -179.889 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.555 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 4.7 t80 -53.91 -53.8 47.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.692 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -63.55 -56.06 29.51 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.362 179.0 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.497 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 83.7 Cg_exo -45.34 -27.52 3.2 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.118 1.879 . . . . 0.0 111.821 179.593 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.596 HD13 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -64.89 -59.14 4.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.756 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 25' ' ' GLU . 4.2 pp -68.53 -19.23 64.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.109 0.48 . . . . 0.0 110.161 178.993 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.455 ' N ' HD12 ' A' ' 28' ' ' LEU . 40.3 tt0 -69.65 -34.69 74.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.453 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.7 t -66.42 -14.99 62.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.383 -179.827 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.538 HD11 ' HG3' ' A' ' 57' ' ' PRO . 95.9 mt -65.65 -10.26 34.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.804 0.335 . . . . 0.0 110.801 179.858 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.3 m -113.61 12.61 18.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.065 -179.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -78.68 143.05 36.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.847 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -67.79 -25.41 65.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.06 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -87.56 135.06 33.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.953 -179.965 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 27.9 p-90 -82.24 -35.22 28.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.991 -179.897 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.451 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 40.7 ttp180 -58.73 -30.7 67.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.151 179.785 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.0 mm -82.79 -41.19 17.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.353 179.884 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.459 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 39.6 ttm180 -63.63 -40.14 96.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.553 -179.362 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.527 ' HA2' HG13 ' A' ' 69' ' ' VAL . . . -59.09 -60.55 8.67 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.3 -179.892 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.12 -27.79 2.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.638 0.256 . . . . 0.0 111.317 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 39' ' ' ARG . . . -58.94 -56.33 23.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.839 179.611 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.511 ' HB1' HD23 ' A' ' 58' ' ' LEU . . . -68.94 -25.33 64.5 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.758 0.313 . . . . 0.0 111.215 179.946 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.6 m95 -55.44 -44.96 76.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.054 -179.453 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.9 mm -99.95 -21.07 5.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.022 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.634 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.9 tt -58.21 -30.77 40.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.765 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.494 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -65.39 -16.72 63.2 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.955 -179.399 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.65 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.7 OUTLIER -70.81 -25.04 62.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.641 0.258 . . . . 0.0 111.617 -179.573 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.511 ' HE2' ' H ' ' A' ' 21' ' ' ASP . 42.4 m-85 -72.18 -23.63 61.3 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.721 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 56.84 26.21 11.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.932 0.396 . . . . 0.0 111.425 179.83 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -101.99 160.54 14.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.218 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.533 ' O ' HG22 ' A' ' 55' ' ' VAL . 9.8 pt-20 -65.58 -34.14 77.54 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.247 0.546 . . . . 0.0 110.62 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 18.7 ttm180 -69.36 -10.24 57.01 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.415 179.204 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.418 ' C ' ' HD2' ' A' ' 57' ' ' PRO . . . -104.11 -21.07 13.63 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.795 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.533 HG22 ' O ' ' A' ' 52' ' ' GLU . 19.4 m -76.61 -35.99 26.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.113 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.588 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 31.7 tt0 -57.8 -51.88 78.5 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 111.49 0.181 . . . . 0.0 111.49 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.634 ' HG2' HD13 ' A' ' 46' ' ' ILE . 66.6 Cg_exo -52.03 -23.43 16.99 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.131 1.888 . . . . 0.0 112.151 179.399 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.554 HD22 ' HA ' ' A' ' 73' ' ' ALA . 50.6 mt -80.02 -35.97 36.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.496 179.713 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.24 -54.27 37.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.028 -179.588 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -70.12 -14.43 62.65 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -178.366 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.734 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 tp -90.05 -27.45 19.7 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.442 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.632 HD11 HD11 ' A' ' 77' ' ' LEU . 10.1 mt -65.81 -9.77 31.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.139 0.495 . . . . 0.0 110.475 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -121.7 1.8 10.01 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.071 -179.683 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -61.01 -32.15 71.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.19 0.519 . . . . 0.0 111.289 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 52.47 28.65 6.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.333 -0.849 . . . . 0.0 112.02 179.833 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.498 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 7.4 t -85.33 -25.45 27.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.983 0.421 . . . . 0.0 110.818 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 127.65 -108.83 0.99 Allowed Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.966 -179.832 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.451 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.9 OUTLIER -59.7 -27.46 66.45 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.974 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.734 HG12 ' HG ' ' A' ' 61' ' ' LEU . 17.8 t -66.99 -34.54 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.932 178.968 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -75.73 -49.33 18.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.994 179.16 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 56.7 m -67.1 -21.37 65.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.996 179.414 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -62.74 -63.39 4.67 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.301 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.554 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -55.23 -25.77 35.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.879 0.371 . . . . 0.0 111.124 179.348 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.49 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.78 -58.28 8.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.55 -179.63 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -64.6 -37.59 88.1 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.324 -179.729 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.494 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 38.6 m -55.79 -38.38 69.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.208 -179.694 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.632 HD11 HD11 ' A' ' 62' ' ' LEU . 15.8 mt -69.73 -60.02 2.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.666 179.303 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.433 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 29.9 mt-10 -51.7 -25.93 8.29 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.245 0.545 . . . . 0.0 109.927 178.436 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' A' ' 76' ' ' SER . 6.3 tt0 -70.11 -44.09 69.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.904 179.164 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.447 ' HB ' HG11 ' A' ' 85' ' ' VAL . 79.9 mt -57.59 -58.43 6.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.201 178.901 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.495 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 70.29 135.41 0.1 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.915 179.518 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 124.73 174.81 14.11 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.828 179.685 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -61.79 -22.91 65.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.989 0.423 . . . . 0.0 110.551 179.562 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.563 ' HD2' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -55.13 -63.21 1.23 Allowed 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.829 -179.896 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.447 HG11 ' HB ' ' A' ' 80' ' ' ILE . 5.2 m -70.28 -24.55 25.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.815 179.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -55.86 -28.71 57.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.498 -178.566 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.19 -26.44 26.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.861 0.363 . . . . 0.0 110.706 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.48 -46.18 60.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.087 179.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.58 ' HE2' ' N ' ' A' ' 89' ' ' MET . 0.0 OUTLIER -72.11 -37.45 69.52 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 179.828 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -55.56 -37.15 67.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.95 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -81.52 -20.96 38.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.901 179.328 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.555 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -83.21 -26.13 31.1 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.663 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.66 -24.85 67.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.728 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -80.04 -22.7 42.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.293 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 30.2 p -120.39 15.93 12.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.173 179.227 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -56.33 127.55 43.92 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 114.794 -1.093 . . . . 0.0 113.468 -178.936 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.0 t -139.78 130.3 25.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.963 0.411 . . . . 0.0 110.55 178.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.6 -132.03 51.29 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.705 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -69.49 -33.92 73.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.635 0.255 . . . . 0.0 111.589 -179.716 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.473 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -49.79 -33.01 15.28 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.008 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.404 ' C ' ' N ' ' A' ' 103' ' ' VAL . 49.9 ttp180 -79.76 -52.52 7.82 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -178.823 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -45.91 -23.24 0.27 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.263 0.554 . . . . 0.0 110.429 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.49 HG21 ' HB1' ' A' ' 74' ' ' ALA . 55.6 t -71.47 -60.24 2.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.341 179.664 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.542 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -54.06 -49.95 67.85 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.208 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.0 t -64.87 -63.23 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.215 -0.902 . . . . 0.0 113.008 -177.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -55.39 -46.29 76.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.626 -178.379 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.495 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 39.2 t80 -60.0 -37.54 80.02 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.196 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.579 ' O ' HD12 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -49.82 -25.31 2.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.373 -178.116 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.2 6.27 1.02 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.683 -179.767 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 76.8 p -96.4 -71.24 0.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.595 0.236 . . . . 0.0 111.445 -179.887 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 62.4 t-80 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.805 179.964 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.73 0.3 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.77 160.16 19.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.967 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 61.23 170.64 0.1 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.152 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 57.49 18.3 4.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.903 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -127.02 -30.12 2.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.734 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -67.24 -17.01 64.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.91 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 36.6 m95 -114.2 37.71 3.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.002 -179.787 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.1 p -70.54 143.86 14.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.177 179.999 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.567 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 59.7 ttt180 70.88 8.25 6.48 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.719 179.607 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.486 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 70.1 ttt180 -61.63 105.06 0.49 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.382 178.731 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.486 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 3.8 m-20 70.55 2.13 3.96 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.892 -179.226 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.567 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 4.6 t -94.49 166.94 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.846 179.953 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.489 ' H ' HG12 ' A' ' 12' ' ' VAL . 36.5 t -156.9 -39.38 0.07 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.944 179.815 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.509 HG21 ' HB3' ' A' ' 17' ' ' SER . 9.7 t -70.22 160.45 32.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.584 179.685 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -96.03 -70.18 0.72 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -179.12 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.695 HD12 ' N ' ' A' ' 17' ' ' SER . 1.3 pp -86.41 -30.75 21.86 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.385 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.695 ' N ' HD12 ' A' ' 16' ' ' LEU . 32.3 t -54.99 -44.52 74.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.649 0.261 . . . . 0.0 111.018 -179.404 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 21.7 ttp180 -168.07 110.12 0.59 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.118 179.617 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.421 ' HB2' ' HB3' ' A' ' 23' ' ' ALA . 1.0 OUTLIER -133.06 -39.5 0.94 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.471 179.525 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 102.94 -88.37 0.65 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.773 179.576 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -125.04 13.06 8.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.611 0.243 . . . . 0.0 111.154 -179.56 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -100.08 -45.03 5.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.862 -179.79 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.593 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -106.72 13.13 28.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.631 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.531 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -61.04 -51.12 70.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.984 0.421 . . . . 0.0 110.584 179.904 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -62.94 -52.99 59.5 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.1 179.806 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.593 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 74.3 Cg_exo -40.61 -28.93 0.36 Allowed 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 122.257 1.972 . . . . 0.0 111.722 179.285 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 49.2 mt -72.64 -55.04 7.46 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.101 178.714 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.698 HD12 HD12 ' A' ' 31' ' ' LEU . 23.8 tp -63.09 -22.9 67.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.167 179.021 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -83.18 -34.17 26.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.996 179.763 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.3 t -66.23 -16.18 63.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.901 179.772 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.698 HD12 HD12 ' A' ' 28' ' ' LEU . 80.3 mt -63.4 -13.22 37.42 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.877 -179.999 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 90.3 p -100.64 22.34 12.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.773 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.01 146.18 27.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.963 -179.827 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -66.44 -20.9 66.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.385 -179.784 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -83.87 162.8 20.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.379 . . . . 0.0 111.176 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 14.5 p90 -103.11 -40.34 6.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.175 -179.997 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -61.72 -30.34 70.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.137 -179.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 31.8 mm -78.51 -42.05 25.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.452 -179.431 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.445 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 41.6 ttm180 -62.96 -44.7 95.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.302 -179.632 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.24 -57.92 12.05 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.892 -179.679 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.89 -28.9 4.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.718 0.294 . . . . 0.0 111.582 -179.811 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.439 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -63.7 -50.56 68.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.951 179.862 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.57 ' CB ' HD22 ' A' ' 61' ' ' LEU . . . -74.82 -25.23 58.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.432 -179.893 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -60.63 -37.98 83.25 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.408 -179.878 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.2 mm -99.53 -19.77 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.799 -179.397 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.469 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.3 tt -59.81 -36.79 68.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -178.417 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.445 ' HA2' HD11 ' A' ' 80' ' ' ILE . . . -70.97 -7.44 62.27 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.465 -0.874 . . . . 0.0 113.39 -179.099 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.556 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.9 OUTLIER -70.78 -26.45 63.34 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -179.241 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -87.03 -27.03 23.44 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.813 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.571 ' HG3' HD13 ' A' ' 80' ' ' ILE . 1.1 mp0 60.74 60.94 1.78 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.76 0.314 . . . . 0.0 111.524 -179.607 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -127.99 176.95 7.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.787 179.47 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -64.22 -34.23 77.61 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.931 179.777 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.523 ' HE ' ' HA ' ' A' ' 53' ' ' ARG . 1.8 mmp_? -68.56 -11.44 59.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.252 -179.899 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.39 10.38 33.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.956 -179.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.5 t -91.54 -58.49 3.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.056 -179.275 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.434 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 39.4 tt0 -60.5 -46.28 97.37 Favored Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.094 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.543 ' HG3' HD13 ' A' ' 28' ' ' LEU . 95.2 Cg_exo -43.67 -48.08 9.07 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.191 1.927 . . . . 0.0 112.647 -179.898 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.486 HD22 ' HA ' ' A' ' 73' ' ' ALA . 10.3 mt -59.74 -36.51 76.76 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.276 -179.477 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.695 HD11 ' HB1' ' A' ' 88' ' ' ALA . 40.2 mm -61.39 -61.15 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.181 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.527 ' HD2' HD13 ' A' ' 31' ' ' LEU . 5.9 ptpt -70.25 -11.91 61.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.978 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.656 HD23 ' H ' ' A' ' 73' ' ' ALA . 1.3 tp -89.97 -45.75 8.98 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -177.821 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.491 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 3.9 pp -67.26 -8.38 31.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 111.291 -178.438 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -101.71 -4.32 26.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.189 -179.877 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.436 ' OD2' ' HA ' ' A' ' 61' ' ' LEU . 2.1 m-20 -61.3 -33.85 74.25 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.61 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.616 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 38.4 m-20 59.6 27.58 16.82 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.183 -179.35 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.491 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 11.7 m -82.12 -31.83 30.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.59 -179.335 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 135.78 -109.36 0.74 Allowed Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.792 -179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -58.14 -28.71 64.95 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.757 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.491 ' HB ' ' HB2' ' A' ' 66' ' ' SER . 49.4 t -65.5 -45.9 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.477 178.688 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.616 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 53.0 ttp180 -62.0 -48.88 78.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.389 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.9 m -67.12 -24.8 65.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.205 -179.993 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -55.37 -69.78 1.16 Allowed Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.386 -179.903 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.656 ' H ' HD23 ' A' ' 61' ' ' LEU . . . -47.56 -31.98 4.94 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 179.295 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.86 -47.64 84.1 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.26 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -71.29 -40.3 70.95 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.157 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.596 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 6.7 p -54.46 -27.85 40.37 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.692 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.659 ' HB3' HG11 ' A' ' 85' ' ' VAL . 17.6 mt -55.12 -60.69 3.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.743 0.306 . . . . 0.0 110.696 179.944 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 34.2 mt-10 -48.88 -36.9 18.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.989 178.262 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.596 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 22.1 mt-30 -67.3 -30.4 70.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.855 179.84 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.571 HD13 ' HG3' ' A' ' 50' ' ' GLN . 50.6 mm -80.1 -60.48 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.337 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.597 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . 150.45 142.89 3.63 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.479 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 86' ' ' ARG . . . -69.27 -50.03 35.66 Favored Glycine 0 C--O 1.223 -0.569 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.16 -179.475 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -55.27 -35.94 65.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.586 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.597 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.0 OUTLIER -86.2 -58.59 2.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.005 0.431 . . . . 0.0 111.484 -179.046 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.659 HG11 ' HB3' ' A' ' 77' ' ' LEU . 75.7 t -60.09 -21.75 22.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.734 -179.489 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 12.1 ttp180 -52.95 -31.17 38.9 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.926 0.393 . . . . 0.0 110.608 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.05 -33.29 70.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.775 179.219 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.695 ' HB1' HD11 ' A' ' 59' ' ' ILE . . . -71.58 -46.27 59.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.441 179.444 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.621 ' HE3' HD23 ' A' ' 92' ' ' LEU . 24.8 mmm -63.08 -48.95 76.42 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.819 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -51.27 -33.27 27.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.617 178.829 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 60.7 tptt -79.03 -26.41 43.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.0 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.625 HD21 ' O ' ' A' ' 100' ' ' ALA . 2.0 tp -82.29 -25.55 33.89 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.566 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.93 -22.5 65.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.269 0.557 . . . . 0.0 109.604 178.897 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -80.25 -29.75 38.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.556 179.041 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 15.5 p -108.61 19.05 20.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.673 178.97 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.508 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -51.51 114.14 2.82 Favored Glycine 0 N--CA 1.447 -0.597 0 CA-C-N 115.237 -0.892 . . . . 0.0 113.235 -179.117 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.0 t -139.8 130.1 25.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.857 0.36 . . . . 0.0 110.799 179.348 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.29 -127.85 44.59 Favored Glycine 0 CA--C 1.519 0.326 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.862 179.929 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.485 ' O ' HG23 ' A' ' 103' ' ' VAL . 24.6 t80 -74.04 -31.52 62.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.71 0.29 . . . . 0.0 111.278 -179.808 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.625 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.66 -37.05 48.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.032 -179.248 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.508 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 29.6 ttt180 -67.37 -58.61 4.46 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.371 -179.535 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -47.03 -24.77 0.68 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.788 -179.973 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 55.6 t -66.01 -60.67 2.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.506 179.846 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.584 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -59.26 -39.66 83.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.901 -179.559 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 38.5 t -64.94 -58.22 8.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.69 -0.687 . . . . 0.0 112.445 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.577 ' N ' HD22 ' A' ' 106' ' ' ASN . 0.8 OUTLIER -68.76 -43.33 76.01 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 -178.03 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.553 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 62.6 t80 -60.83 -45.6 93.83 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -178.41 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.504 ' HB3' ' O ' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -50.13 -19.66 0.81 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.709 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -71.27 6.58 1.64 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.765 179.423 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 26.5 p -92.91 -40.46 10.59 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.017 0.436 . . . . 0.0 110.109 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.985 179.333 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.3 mtp . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.95 0.405 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.34 -2.21 1.0 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.938 179.935 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -155.9 -17.31 0.1 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.822 179.99 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -99.46 -55.23 2.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.128 -179.758 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -130.34 130.56 44.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.918 -179.699 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -137.82 -22.45 1.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.144 179.946 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 17.1 p-90 -128.0 22.37 6.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.959 -179.964 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 21.7 t -106.27 -50.35 8.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.012 -179.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.436 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 99.5 mtt180 -122.81 27.68 7.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.103 -179.788 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -58.77 103.2 0.15 Allowed 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.033 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.9 t70 65.16 -1.28 0.92 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.354 -179.968 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.436 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 25.8 t -81.95 -96.99 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.31 -179.422 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.4 m 48.92 27.45 1.63 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-O 120.741 0.305 . . . . 0.0 111.332 -179.862 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.569 HG23 ' HA ' ' A' ' 18' ' ' ARG . 98.2 m -149.21 97.88 2.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.69 -179.736 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.65 ' N ' ' H ' ' A' ' 20' ' ' GLY . . . -96.06 -73.75 0.58 Allowed 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.805 179.383 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.428 ' C ' HD13 ' A' ' 16' ' ' LEU . 3.1 tm? -91.42 -68.95 0.76 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.142 0.496 . . . . 0.0 109.812 177.963 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 37.1 t -92.27 -52.79 4.51 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.857 177.983 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.569 ' HA ' HG23 ' A' ' 14' ' ' THR . 70.2 ttt180 175.0 73.5 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.098 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.563 ' H ' ' H ' ' A' ' 15' ' ' ALA . 24.9 mtt -133.25 -44.44 0.85 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.796 0.331 . . . . 0.0 111.383 -179.587 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.65 ' H ' ' N ' ' A' ' 15' ' ' ALA . . . 73.14 114.16 0.07 OUTLIER Glycine 0 CA--C 1.519 0.324 0 C-N-CA 121.1 -0.571 . . . . 0.0 113.231 179.537 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 58.3 9.3 0.99 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 179.492 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -106.94 -34.26 7.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.991 0.424 . . . . 0.0 110.043 179.524 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.26 18.72 21.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.992 179.761 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.8 t80 -55.33 -53.19 59.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.333 179.5 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.39 -57.05 21.94 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.573 178.996 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.515 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 96.4 Cg_exo -41.74 -33.2 1.84 Allowed 'Trans proline' 0 C--N 1.359 1.109 0 C-N-CA 122.321 2.014 . . . . 0.0 111.607 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 22.8 mt -61.93 -58.25 8.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.927 178.706 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.735 HD12 HD12 ' A' ' 31' ' ' LEU . 11.0 tp -64.75 -21.15 66.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.911 178.693 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -74.38 -33.16 62.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.258 179.828 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.1 m -66.44 -17.34 64.73 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.753 -179.753 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.735 HD12 HD12 ' A' ' 28' ' ' LEU . 81.8 mt -65.49 -6.75 11.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.838 0.352 . . . . 0.0 110.804 179.852 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 53.1 m -121.62 17.07 11.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.356 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.483 HD21 ' HB3' ' A' ' 35' ' ' ASP . 11.4 t30 -88.04 137.19 32.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.858 -179.785 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -53.28 -37.48 62.23 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.584 -179.575 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.483 ' HB3' HD21 ' A' ' 33' ' ' ASN . 16.9 t70 -76.09 133.65 40.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.705 -179.672 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -92.03 -27.27 17.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.363 -179.559 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 -60.61 -36.17 77.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.139 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.8 mt -81.91 -38.92 16.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.17 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.484 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 42.6 ttm180 -56.43 -26.07 52.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.597 179.85 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.42 -63.27 3.46 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.219 179.723 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.412 ' HA ' ' HB2' ' A' ' 44' ' ' TRP . . . -48.82 -24.36 1.41 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.791 0.329 . . . . 0.0 111.346 179.787 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.426 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.98 -57.17 13.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.348 -179.957 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.16 -24.75 62.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.89 0.376 . . . . 0.0 111.195 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.437 ' NE1' ' HA2' ' A' ' 72' ' ' GLY . 6.5 m95 -55.42 -44.69 76.5 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.253 -178.884 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.4 mt -99.11 -20.4 5.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.755 0.312 . . . . 0.0 111.706 -179.381 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.596 HD13 ' HG2' ' A' ' 57' ' ' PRO . 1.4 tt -55.48 -34.12 33.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.681 -179.086 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -65.23 -27.57 72.55 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.783 -0.723 . . . . 0.0 113.334 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -70.73 -0.04 8.04 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.356 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -91.51 -38.22 12.66 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 -179.829 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.568 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.0 OUTLIER 69.57 44.96 0.84 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.272 0.558 . . . . 0.0 110.714 179.831 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.447 ' O ' HG23 ' A' ' 55' ' ' VAL . 4.9 m-20 -126.94 164.06 22.29 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.907 -179.843 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -61.57 -40.78 95.98 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.103 -179.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.503 ' HG3' HD22 ' A' ' 28' ' ' LEU . 14.0 ttm180 -67.25 -9.65 42.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.798 179.889 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.549 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -104.25 -8.89 19.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.14 -179.003 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 51' ' ' ASP . 71.2 t -91.72 -36.73 8.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.517 -179.767 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.608 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 13.5 tt0 -60.27 -51.93 76.74 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -179.395 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 51.0 Cg_exo -54.99 -17.67 14.87 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 122.273 1.982 . . . . 0.0 112.821 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.516 HD13 HD12 ' A' ' 77' ' ' LEU . 14.5 mt -85.82 -36.06 20.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.965 -179.76 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 49.6 mm -61.15 -53.34 50.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.801 -179.452 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -70.03 -13.71 62.35 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.88 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.677 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.9 mp -89.86 -36.36 15.11 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -177.961 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.572 HD13 HD22 ' A' ' 92' ' ' LEU . 9.0 mt -63.48 -9.16 11.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.836 0.351 . . . . 0.0 111.132 -178.34 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -111.78 -11.88 13.9 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.365 -179.823 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.424 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 3.0 t70 -61.07 -32.49 72.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.12 0.486 . . . . 0.0 111.111 179.978 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.4 t70 47.61 30.35 1.71 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.793 179.885 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.46 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 22.7 t -86.28 -36.26 19.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.864 0.364 . . . . 0.0 111.426 -179.767 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 130.2 -96.95 0.37 Allowed Glycine 0 C--O 1.228 -0.253 0 N-CA-C 111.049 -0.82 . . . . 0.0 111.049 -178.875 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -54.06 -32.61 55.17 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.966 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.677 HG12 ' HG ' ' A' ' 61' ' ' LEU . 16.3 t -73.77 -59.99 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.032 179.286 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.418 ' HA ' ' O ' ' A' ' 61' ' ' LEU . 7.6 tmm_? -69.4 -63.33 1.09 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.675 -179.209 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 22.9 t -51.76 -24.89 6.51 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.005 0.431 . . . . 0.0 110.764 -179.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.437 ' HA2' ' NE1' ' A' ' 44' ' ' TRP . . . -63.51 -61.25 6.43 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.699 -0.762 . . . . 0.0 111.714 179.347 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.51 -25.47 68.04 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.722 0.296 . . . . 0.0 110.973 179.243 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -52.42 -46.26 66.28 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.115 -179.366 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.468 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 11.5 ptp180 -81.34 -30.77 33.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.776 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.521 ' HA ' HE21 ' A' ' 79' ' ' GLN . 14.7 m -53.19 -44.14 67.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.353 -179.673 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.556 HD23 ' HE1' ' A' ' 89' ' ' MET . 9.0 mp -55.47 -59.61 4.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.836 179.766 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -52.37 -31.23 32.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.472 179.489 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.521 HE21 ' HA ' ' A' ' 76' ' ' SER . 34.0 mt-30 -62.95 -36.94 85.13 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.911 0.386 . . . . 0.0 110.395 179.631 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.568 HG23 ' HG3' ' A' ' 50' ' ' GLN . 69.2 mt -71.63 -55.2 14.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.543 179.432 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.564 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 63.12 -175.57 8.22 Favored Glycine 0 N--CA 1.453 -0.218 0 CA-C-N 115.979 -0.555 . . . . 0.0 113.383 179.407 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.595 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 73.49 168.35 14.98 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.349 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.445 ' HG3' HH21 ' A' ' 86' ' ' ARG . 40.2 tt0 -55.65 -21.12 16.46 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.927 0.394 . . . . 0.0 110.724 179.621 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.595 HH11 ' HA3' ' A' ' 82' ' ' GLY . 2.7 mpt_? -60.84 -65.6 0.66 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.242 -178.855 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.609 HG22 ' HE1' ' A' ' 89' ' ' MET . 2.5 p -70.88 -23.13 23.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.181 0.515 . . . . 0.0 110.105 179.492 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.445 HH21 ' HG3' ' A' ' 83' ' ' GLU . 23.2 ttp180 -54.61 -19.46 6.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.273 -179.815 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -79.56 -36.65 37.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.43 -35.87 72.76 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.606 179.607 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.609 ' HE1' HG22 ' A' ' 85' ' ' VAL . 8.4 mmt -59.23 -62.74 1.66 Allowed 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.86 178.987 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -51.56 -36.55 45.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.93 179.394 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -73.53 -28.16 61.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.589 -179.825 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.662 HD23 ' HB2' ' A' ' 104' ' ' ALA . 2.4 tp -86.19 -27.15 24.71 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.581 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.28 -28.28 64.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.684 179.039 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -80.14 -27.51 39.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.766 179.455 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.4 p -112.16 27.03 10.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.484 179.245 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.546 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -50.53 119.8 7.84 Favored Glycine 0 N--CA 1.448 -0.552 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.818 -178.852 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 t -142.58 130.68 21.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.521 -0.339 . . . . 0.0 110.42 179.05 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.92 -132.37 19.43 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.318 -179.567 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.07 -15.88 23.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.803 0.335 . . . . 0.0 110.588 179.998 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.454 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -56.93 -37.06 70.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.648 179.638 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.546 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 61.0 ttt180 -57.19 -61.28 2.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.343 179.458 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -53.32 -32.8 50.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.309 179.379 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.454 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 9.6 t -62.45 -51.94 66.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.499 179.974 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.662 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -56.15 -62.24 1.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -178.914 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 106' ' ' ASN . 6.0 p -57.77 -53.38 45.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.022 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.502 ' N ' HG13 ' A' ' 105' ' ' VAL . 41.2 t30 -61.83 -39.16 90.83 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -178.787 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.564 ' OH ' ' HA2' ' A' ' 81' ' ' GLY . 63.4 t80 -62.16 -23.96 66.9 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 120.836 0.35 . . . . 0.0 111.263 -178.613 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.2 mt -53.65 -22.78 9.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.411 -179.757 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -77.63 7.17 5.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.246 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.0 m -130.05 -52.97 1.12 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.444 -179.548 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 33.9 p-80 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.104 -0.95 . . . . 0.0 111.433 -179.95 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 mtt . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.739 0.305 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 58.92 -174.54 0.09 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.407 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -82.37 -13.41 56.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.902 -179.933 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -77.51 -66.37 0.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.76 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -82.52 138.3 34.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.895 179.843 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -142.89 -30.38 0.53 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.709 -179.958 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 11.3 p-90 -162.22 36.52 0.12 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.705 179.689 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.2 p -64.38 133.37 29.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.962 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.4 ptt180 50.96 20.41 0.79 Allowed 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.074 179.863 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.45 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 46.0 ttt180 -96.86 107.24 19.7 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.79 178.192 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.45 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 19.6 t70 74.92 -3.53 2.58 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 123.401 0.438 . . . . 0.0 110.702 -179.191 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.912 HG13 ' HB3' ' A' ' 15' ' ' ALA . 89.5 t -58.76 -82.85 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.998 -179.95 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 40.7 t 56.34 101.26 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.46 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 59.4 p 47.07 29.18 1.04 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.321 179.177 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.912 ' HB3' HG13 ' A' ' 12' ' ' VAL . . . -89.71 -0.27 57.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.851 179.597 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.48 ' C ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -44.49 -22.03 0.06 Allowed 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.484 -179.363 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.474 ' H ' HD13 ' A' ' 16' ' ' LEU . 61.6 m -52.01 -40.33 60.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.882 0.372 . . . . 0.0 110.858 179.749 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -168.21 88.71 0.25 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.586 179.724 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.559 ' SD ' ' N ' ' A' ' 20' ' ' GLY . 0.0 OUTLIER -133.75 -35.15 0.99 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.671 -179.358 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.559 ' N ' ' SD ' ' A' ' 19' ' ' MET . . . 116.56 -109.72 2.0 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.696 -179.386 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.486 ' HA ' ' HB2' ' A' ' 24' ' ' PHE . 20.1 t70 -106.97 -11.5 15.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.673 0.273 . . . . 0.0 111.105 -179.7 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -59.21 -44.21 92.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.131 -179.371 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.538 ' HB3' ' SD ' ' A' ' 19' ' ' MET . . . -105.64 15.05 27.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.135 179.659 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.486 ' HB2' ' HA ' ' A' ' 21' ' ' ASP . 3.1 t80 -49.44 -44.65 45.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.537 178.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -63.48 -56.71 24.31 Favored Pre-proline 0 N--CA 1.465 0.297 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.307 -179.584 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 70.5 Cg_exo -37.39 -25.24 0.06 OUTLIER 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 122.863 2.376 . . . . 0.0 112.759 179.244 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 27.1 mt -72.33 -54.26 9.99 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.742 179.215 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.573 HD23 HD11 ' A' ' 46' ' ' ILE . 12.9 mt -67.96 -26.06 65.75 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.134 179.044 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 11.6 mm-40 -63.72 -41.04 98.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.497 -179.614 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.2 m -66.05 -15.45 63.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.578 -179.765 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.543 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 88.1 mt -67.63 -10.98 57.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.726 0.298 . . . . 0.0 111.056 -179.728 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.5 t -98.09 15.88 22.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.089 -179.868 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.702 HD21 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -86.69 149.63 24.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.96 0.41 . . . . 0.0 111.12 -179.903 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.74 -37.46 82.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.994 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.13 158.21 32.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.956 -179.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 1.5 p90 -106.25 -21.0 13.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.962 179.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -64.76 -51.57 61.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.799 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.0 mt -62.32 -40.41 87.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.439 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.702 ' HB2' HD21 ' A' ' 33' ' ' ASN . 31.1 ttm180 -63.12 -20.98 65.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.534 179.56 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.92 -64.53 3.86 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.549 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.56 -36.31 4.57 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.694 0.283 . . . . 0.0 111.498 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.23 -47.94 83.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.992 0.425 . . . . 0.0 110.338 179.438 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.04 -30.91 69.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.112 179.533 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -70.73 -34.01 71.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.519 -178.704 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.424 ' HA ' HD22 ' A' ' 48' ' ' ASN . 35.9 mt -98.32 -19.34 5.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.82 0.343 . . . . 0.0 111.502 -179.464 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.609 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -56.1 -35.63 42.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.136 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.21 -18.48 78.06 Favored Glycine 0 C--N 1.329 0.16 0 C-N-CA 120.566 -0.826 . . . . 0.0 113.592 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.424 HD22 ' HA ' ' A' ' 45' ' ' ILE . 17.6 m-80 -58.16 -34.22 70.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.007 0.403 . . . . 0.0 111.098 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.438 ' C ' ' H ' ' A' ' 51' ' ' ASP . 12.0 m-85 -94.07 118.67 31.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.964 0.411 . . . . 0.0 110.963 179.593 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -72.13 20.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.81 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.438 ' H ' ' C ' ' A' ' 49' ' ' PHE . 28.7 t0 -83.8 137.25 33.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.754 0.311 . . . . 0.0 110.552 179.907 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -10.32 32.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.788 -179.044 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.486 ' HG2' HD11 ' A' ' 28' ' ' LEU . 12.3 ttt180 -62.28 -32.36 73.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.775 0.321 . . . . 0.0 110.652 -179.852 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.609 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -104.8 20.15 19.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.58 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.0 p -73.64 -38.66 52.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.823 0.344 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.452 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 19.2 tt0 -60.29 -53.35 65.71 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.591 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.477 ' O ' HD13 ' A' ' 61' ' ' LEU . 69.7 Cg_exo -38.91 -53.16 2.01 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.494 2.129 . . . . 0.0 112.635 179.702 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.515 ' HB3' HD21 ' A' ' 77' ' ' LEU . 11.6 mt -55.58 -48.29 75.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.5 -179.503 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 35.8 mm -58.03 -54.61 29.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.657 -179.46 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -69.81 -11.96 61.26 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.534 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.64 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.4 OUTLIER -87.46 -47.16 8.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.843 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.655 HD13 HD22 ' A' ' 92' ' ' LEU . 5.6 mt -56.24 -16.91 6.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.12 0.486 . . . . 0.0 110.846 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.06 -12.81 14.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.319 179.951 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.424 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 6.6 t0 -61.13 -35.52 77.28 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.18 0.514 . . . . 0.0 110.911 -179.958 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.65 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 42.9 m-20 52.59 29.95 7.93 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.747 179.792 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.469 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 43.9 t -84.36 -3.62 58.4 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.82 0.343 . . . . 0.0 111.028 179.892 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.88 -90.64 1.46 Allowed Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.434 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.79 -45.68 89.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.162 0.506 . . . . 0.0 109.801 179.435 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.64 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.3 t -69.19 -42.52 81.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.379 -179.873 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.65 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 0.9 OUTLIER -66.83 -62.84 1.24 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.023 -179.816 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.444 ' HA ' HH21 ' A' ' 70' ' ' ARG . 95.2 p -54.67 -24.94 23.97 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.005 179.715 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -58.58 -35.19 79.47 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.601 -179.915 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.467 ' O ' HD23 ' A' ' 77' ' ' LEU . . . -73.66 -38.61 64.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.556 0.217 . . . . 0.0 111.073 179.79 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.538 ' HB2' HH22 ' A' ' 70' ' ' ARG . . . -42.49 -42.06 3.17 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.027 -179.04 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -84.14 -31.23 25.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.285 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.665 ' HA ' HE21 ' A' ' 79' ' ' GLN . 67.7 m -63.06 -46.3 88.14 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.743 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.848 HD12 HG13 ' A' ' 85' ' ' VAL . 3.8 mm? -55.34 -60.93 2.72 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.73 0.3 . . . . 0.0 111.534 -178.909 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -61.25 -27.04 68.17 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.758 0.313 . . . . 0.0 111.459 179.807 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.665 HE21 ' HA ' ' A' ' 76' ' ' SER . 5.0 mt-30 -70.55 -24.57 62.82 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.174 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.428 ' HB ' ' CG2' ' A' ' 85' ' ' VAL . 85.0 mt -74.86 -60.99 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.141 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 179.55 -135.68 2.58 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 119.911 -1.137 . . . . 0.0 113.711 -179.49 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.618 ' H ' HH11 ' A' ' 84' ' ' ARG . . . -127.51 -78.89 0.27 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 121.151 -0.547 . . . . 0.0 112.508 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -58.67 -21.27 53.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.82 0.343 . . . . 0.0 111.766 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.618 HH11 ' H ' ' A' ' 82' ' ' GLY . 4.3 mpt_? -75.97 -62.88 1.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.243 0.544 . . . . 0.0 110.28 -178.715 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.848 HG13 HD12 ' A' ' 77' ' ' LEU . 39.4 t -70.72 -20.43 22.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.988 179.653 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 23.3 ttm180 -46.47 -26.71 0.91 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.746 -179.939 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.5 -36.3 22.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.778 179.794 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.91 -44.26 77.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.36 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.433 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 4.3 ppp? -64.3 -28.69 69.89 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.912 0.387 . . . . 0.0 110.049 179.88 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.418 ' N ' ' SD ' ' A' ' 89' ' ' MET . 22.5 mt-10 -70.42 -37.6 74.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.636 179.015 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.471 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 7.3 tmtm? -66.68 -33.83 76.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.393 179.358 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.655 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -85.84 -27.37 25.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.931 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.28 -30.37 69.41 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.456 179.064 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -80.18 -25.07 39.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.358 179.934 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 61.8 p -110.96 20.89 17.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.14 179.067 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.564 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -51.34 119.19 7.74 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.701 -178.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.1 m -152.67 130.27 11.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.545 -0.328 . . . . 0.0 110.503 179.189 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.46 -144.61 49.34 Favored Glycine 0 CA--C 1.518 0.275 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.481 -179.839 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -68.71 -29.33 67.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.81 0.338 . . . . 0.0 110.839 179.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.634 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.13 -41.73 49.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.519 -179.911 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.564 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 74.7 ttt180 -67.79 -54.49 18.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.524 -179.549 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -45.79 -28.51 1.08 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.281 -179.771 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.524 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 53.6 t -61.8 -60.19 3.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.057 179.242 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.593 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -53.54 -62.02 1.93 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.274 0.559 . . . . 0.0 111.776 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 46.3 t -54.41 -59.22 2.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.843 -178.643 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -56.84 -32.26 65.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.717 0.294 . . . . 0.0 111.612 -179.17 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.424 ' OH ' ' HA2' ' A' ' 82' ' ' GLY . 3.9 t80 -59.34 -27.88 66.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.047 0.451 . . . . 0.0 110.453 -179.678 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 41.8 mt -56.48 -22.25 31.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.398 179.884 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -56.04 -17.83 7.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.475 -179.887 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.1 p -93.7 -64.63 1.06 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.975 179.723 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.465 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 80.0 m80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.323 -0.846 . . . . 0.0 110.718 179.903 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ttt . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.862 0.363 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.3 -24.35 67.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.833 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -109.45 10.13 25.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.732 179.727 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 5' ' ' ASN . 9.9 tp10 61.99 99.69 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.101 179.961 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.441 ' HB3' ' O ' ' A' ' 4' ' ' GLU . 51.2 t30 74.54 -46.08 0.6 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.623 179.902 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.0 tttt 60.06 -92.7 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.637 0.256 . . . . 0.0 111.016 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.488 ' CD1' HG23 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -79.1 -157.87 0.13 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.714 179.717 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.488 HG23 ' CD1' ' A' ' 7' ' ' TRP . 17.0 t 74.59 -7.99 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 120.807 0.337 . . . . 0.0 111.044 -179.641 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -116.97 -28.77 6.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.051 179.759 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 39.2 ptt180 -55.31 124.72 17.99 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.071 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 8.0 m-20 75.38 -25.7 0.2 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.674 -179.769 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.551 HG12 ' H ' ' A' ' 13' ' ' SER . 1.8 t -80.86 -143.5 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.569 -179.898 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.551 ' H ' HG12 ' A' ' 12' ' ' VAL . 17.5 p 62.98 20.04 12.02 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.762 0.315 . . . . 0.0 110.959 -179.858 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.488 HG22 ' O ' ' A' ' 12' ' ' VAL . 1.7 t -174.26 98.59 0.1 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.166 179.621 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 23' ' ' ALA . . . -95.94 -73.1 0.6 Allowed 'General case' 0 C--O 1.231 0.111 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.851 -179.712 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.538 HD12 ' H ' ' A' ' 17' ' ' SER . 0.5 OUTLIER -89.9 -67.49 0.84 Allowed 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.681 178.945 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.538 ' H ' HD12 ' A' ' 16' ' ' LEU . 69.5 p -91.85 -52.56 4.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.307 0.575 . . . . 0.0 110.15 178.316 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 171.97 53.75 0.0 OUTLIER 'General case' 0 C--O 1.232 0.162 0 CA-C-N 114.557 -1.201 . . . . 0.0 109.486 -179.494 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.468 ' SD ' ' HB2' ' A' ' 23' ' ' ALA . 19.8 mtp -109.43 -44.52 3.88 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.18 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.669 ' H ' ' H ' ' A' ' 15' ' ' ALA . . . 93.31 -139.66 14.69 Favored Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.83 -179.928 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -57.91 -28.1 63.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.762 0.315 . . . . 0.0 111.37 -179.751 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -61.96 -30.2 70.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.128 -179.874 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . . . -104.73 19.11 21.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.653 -179.692 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.437 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -58.0 -51.77 68.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 179.698 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.428 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.39 -54.02 47.71 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.725 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.469 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 89.5 Cg_exo -40.1 -35.94 1.34 Allowed 'Trans proline' 0 C--N 1.362 1.272 0 C-N-CA 122.177 1.918 . . . . 0.0 111.433 -179.955 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 27.1 mt -66.86 -53.91 27.65 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.985 178.501 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 31' ' ' LEU . 35.5 tp -61.65 -19.95 62.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.823 179.34 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -75.73 -43.25 47.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.21 -179.614 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.7 m -65.98 -14.37 61.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.363 -179.689 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.528 HD11 HG13 ' A' ' 46' ' ' ILE . 65.9 mt -70.33 -10.43 58.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.271 -179.918 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.6 p -101.79 10.32 40.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.701 179.795 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -81.65 145.76 30.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.102 -179.914 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.76 -18.13 64.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.893 -179.957 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -77.71 142.15 38.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.921 -179.947 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 12.3 p90 -96.59 -22.2 17.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.148 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -72.2 -37.72 69.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.018 0.437 . . . . 0.0 110.693 -179.981 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.546 HD12 ' N ' ' A' ' 38' ' ' ILE . 1.8 mp -81.66 -36.13 14.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.736 -179.766 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.523 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 20.3 ttm180 -65.19 -25.51 67.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.489 -179.955 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.19 -64.59 3.05 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.509 -179.995 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.65 -39.48 24.38 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.661 0.267 . . . . 0.0 110.911 179.76 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 46' ' ' ILE . . . -57.25 -55.39 35.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.236 179.298 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.44 -33.93 71.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.255 179.209 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -64.97 -30.17 71.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.181 -179.814 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.434 ' O ' ' HB2' ' A' ' 48' ' ' ASN . 66.4 mt -98.73 -18.91 6.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.312 -179.887 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.528 HG13 HD11 ' A' ' 31' ' ' LEU . 4.5 mm -50.41 -61.19 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.315 -179.234 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.677 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -68.56 -3.42 33.3 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.85 -0.691 . . . . 0.0 113.992 -178.395 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.586 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER -70.74 0.22 7.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 117.242 0.521 . . . . 0.0 111.078 -179.964 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -106.07 -23.01 12.73 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -179.747 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.614 ' HG3' HG12 ' A' ' 80' ' ' ILE . 0.6 OUTLIER 62.32 20.48 11.83 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.899 0.38 . . . . 0.0 110.946 -179.683 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -96.82 171.9 8.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.149 -179.874 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.427 ' O ' HG12 ' A' ' 55' ' ' VAL . 27.4 tt0 -66.41 -34.12 77.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.161 179.738 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -66.73 -13.23 61.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.963 0.411 . . . . 0.0 111.09 -179.719 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.458 ' HA ' HG23 ' A' ' 46' ' ' ILE . . . -101.68 6.38 41.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.928 -179.304 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 52' ' ' GLU . 1.3 p -92.24 -39.11 11.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.242 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.571 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 35.7 tt0 -60.26 -51.9 76.98 Favored Pre-proline 0 CA--C 1.53 0.211 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -178.99 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.571 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 88.1 Cg_exo -47.07 -49.21 13.07 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 121.881 1.721 . . . . 0.0 111.615 179.507 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.442 HD13 ' HG ' ' A' ' 77' ' ' LEU . 10.3 mt -56.77 -37.37 70.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.376 -179.697 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 55' ' ' VAL . 46.6 mm -61.89 -59.33 4.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.901 0.382 . . . . 0.0 111.985 -179.396 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.3 mmmt -70.02 -9.72 56.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.32 -178.873 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.679 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -87.46 -44.34 11.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -178.327 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.713 HD13 HD22 ' A' ' 92' ' ' LEU . 7.6 mt -59.19 -11.32 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.095 0.474 . . . . 0.0 110.641 -179.119 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -116.03 -14.84 11.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.153 -179.926 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -61.23 -22.95 65.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.248 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.57 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 4.0 p30 41.51 32.28 0.22 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.411 -0.813 . . . . 0.0 112.153 179.786 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.471 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 22.2 t -86.18 -8.73 57.61 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.195 -179.998 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.89 -86.03 1.09 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.248 -179.765 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.45 -42.95 99.56 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.103 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.679 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.2 t -68.69 -49.29 65.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.338 -179.766 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.57 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 51.5 ttp180 -62.7 -41.48 99.16 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.233 -179.758 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 80.5 p -64.26 -31.51 72.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.995 -179.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.21 -28.56 69.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.515 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.576 ' HB2' ' CB ' ' A' ' 61' ' ' LEU . . . -74.3 -58.55 3.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.655 0.264 . . . . 0.0 111.588 -179.844 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.509 ' HA ' HD12 ' A' ' 77' ' ' LEU . . . -60.1 -23.93 64.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.833 -179.204 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.6 ttt-85 -81.39 -47.86 12.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.722 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.677 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 8.7 m -67.22 -30.13 69.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.754 -179.494 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 74' ' ' ALA . 18.3 mt -60.76 -59.81 4.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.833 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -54.45 -36.3 63.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.234 179.392 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.586 HE21 ' HA ' ' A' ' 76' ' ' SER . 47.6 mt-30 -58.93 -37.36 76.51 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.918 0.39 . . . . 0.0 110.913 179.718 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.614 HG12 ' HG3' ' A' ' 50' ' ' GLN . 98.3 mt -71.97 -60.32 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.924 179.856 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 67.96 123.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.632 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.589 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 142.93 175.51 16.11 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.68 179.873 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -65.85 -26.15 67.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.761 0.315 . . . . 0.0 111.11 -179.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.589 HH11 ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -61.84 -54.31 43.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.665 -179.405 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.581 HG11 ' HB ' ' A' ' 80' ' ' ILE . 3.4 m -70.71 -23.8 24.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.84 0.352 . . . . 0.0 111.306 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.506 ' HA ' ' HG2' ' A' ' 89' ' ' MET . 68.5 ttt180 -58.64 -40.87 84.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.968 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.78 -33.45 70.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.738 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.22 -34.23 77.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.412 179.526 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.527 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 17.6 mmm -69.27 -55.44 10.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.042 -0.527 . . . . 0.0 109.981 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -54.03 -33.53 57.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.4 179.377 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -79.24 -22.84 44.22 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.683 179.242 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.713 HD22 HD13 ' A' ' 62' ' ' LEU . 1.8 tp -87.16 -30.67 20.87 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.707 179.858 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.77 -32.17 69.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.527 -179.83 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.473 ' HG3' HG23 ' A' ' 95' ' ' THR . 12.9 pt-20 -80.39 -20.97 42.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.09 0.472 . . . . 0.0 110.15 179.853 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.473 HG23 ' HG3' ' A' ' 94' ' ' GLU . 45.1 p -119.23 28.8 8.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.677 179.015 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -52.66 120.98 13.16 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.222 -0.899 . . . . 0.0 113.75 -178.862 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.3 t -140.63 130.68 24.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.727 0.299 . . . . 0.0 110.334 178.895 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 71.46 -134.71 22.9 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.54 -0.838 . . . . 0.0 111.994 -179.463 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -93.85 -12.29 29.28 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.813 0.34 . . . . 0.0 110.541 179.698 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.653 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.8 -41.17 66.98 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.738 179.454 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -60.48 -56.64 18.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.051 179.86 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -48.56 -23.13 0.89 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.66 179.774 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.571 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 41.8 t -78.19 -55.83 9.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.646 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.65 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -52.93 -41.31 64.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.167 0.508 . . . . 0.0 112.206 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.43 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 85.2 t -64.89 -60.03 3.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.74 -178.318 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -65.54 -47.86 74.44 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.612 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.527 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 67.6 t80 -60.13 -22.63 63.08 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.666 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 4.6 mt -59.48 -20.83 58.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.602 -179.718 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -73.1 -9.7 59.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.338 -179.785 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 69.3 p -127.99 23.67 6.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.204 -179.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 26.4 m80 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.998 179.724 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.876 0.369 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.72 -22.94 67.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.429 -179.743 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -127.07 48.44 2.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.95 0.405 . . . . 0.0 110.822 -179.751 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 60.63 -85.59 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.333 179.896 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -145.13 112.04 5.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.776 0.322 . . . . 0.0 110.949 179.95 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.9 mmmt -137.92 9.3 2.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.047 179.992 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -162.66 107.5 1.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.987 0.422 . . . . 0.0 111.358 -179.97 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.416 ' O ' HG22 ' A' ' 8' ' ' VAL . 9.8 p -170.71 18.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.733 179.847 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -163.71 -31.76 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.964 -179.758 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.42 ' HA ' ' NE ' ' A' ' 10' ' ' ARG . 4.4 mmp_? -47.93 116.7 1.59 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.579 179.625 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.4 t70 77.52 -37.45 0.25 Allowed 'General case' 0 N--CA 1.464 0.259 0 O-C-N 123.656 0.598 . . . . 0.0 111.436 -179.936 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.48 HG11 ' HA ' ' A' ' 23' ' ' ALA . 94.8 t -64.2 135.49 27.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.052 0.453 . . . . 0.0 111.536 -179.621 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.4 t -159.58 -51.32 0.06 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.42 179.726 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.9 t -131.07 17.51 5.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.674 179.579 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -88.61 -1.56 58.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.982 179.825 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.465 ' C ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -48.15 -19.04 0.24 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.927 -179.911 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.456 ' H ' HD13 ' A' ' 16' ' ' LEU . 87.8 p -47.14 -39.43 13.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.473 179.997 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 18' ' ' ARG . 8.9 tpt180 -178.69 89.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.304 -179.446 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -134.04 -43.62 0.8 Allowed 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.517 179.623 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.53 -134.66 6.96 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.739 -179.737 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.409 ' HA ' ' HB2' ' A' ' 24' ' ' PHE . 12.7 m-20 -84.48 -28.45 26.76 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.852 0.358 . . . . 0.0 111.074 -179.804 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -58.87 -31.46 68.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.174 -179.811 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -105.47 6.03 32.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.738 -179.505 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.644 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 14.0 t80 -63.43 -44.84 93.43 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.468 ' HG3' ' NH1' ' A' ' 53' ' ' ARG . 3.2 mt-10 -53.39 -54.18 48.12 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.158 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 98.9 Cg_exo -43.11 -18.18 0.11 Allowed 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 122.719 2.279 . . . . 0.0 113.09 -179.998 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.577 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.8 mt -80.06 -58.15 3.29 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.323 179.724 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.6 -16.24 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.854 179.291 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -69.16 -30.96 69.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.621 178.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.4 t -66.45 -16.76 64.36 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.147 179.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 54.8 mt -62.42 -6.78 3.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.131 -179.859 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.3 m -120.26 23.42 10.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.455 -179.566 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.425 HD21 ' N ' ' A' ' 39' ' ' ARG . 52.0 p-10 -90.15 150.52 21.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.33 -179.749 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -65.88 -35.17 79.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.031 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -75.96 156.48 34.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.206 -179.624 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -106.49 -33.94 7.54 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.098 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.498 ' HG3' HG13 ' A' ' 38' ' ' ILE . 33.2 ptt180 -59.79 -40.18 87.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.045 179.843 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.498 HG13 ' HG3' ' A' ' 37' ' ' ARG . 60.0 mt -77.69 -37.63 24.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.8 179.865 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.503 HH12 HD11 ' A' ' 61' ' ' LEU . 2.1 tmt_? -58.44 -22.96 56.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.379 179.416 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -78.88 -50.17 6.07 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.336 179.775 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.38 -34.25 23.5 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.836 0.35 . . . . 0.0 110.81 179.695 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.496 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -60.99 -55.14 36.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.202 179.291 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.4 ' O ' HG22 ' A' ' 46' ' ' ILE . . . -64.19 -25.97 68.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.953 179.459 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.5 m95 -70.63 -37.43 73.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.234 -178.938 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.542 ' HA ' HD22 ' A' ' 48' ' ' ASN . 52.7 mt -99.17 -19.53 5.87 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-O 120.969 0.414 . . . . 0.0 111.755 -178.66 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.624 HD13 ' HG2' ' A' ' 57' ' ' PRO . 4.0 tt -56.82 -36.02 48.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.489 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.521 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -77.97 -22.15 69.45 Favored Glycine 0 CA--C 1.518 0.242 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.369 -178.996 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.542 HD22 ' HA ' ' A' ' 45' ' ' ILE . 36.2 m-80 -70.75 2.14 4.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.352 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.444 ' HB3' ' OD2' ' A' ' 51' ' ' ASP . 36.8 m-85 -107.97 -25.42 11.18 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.788 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.786 HE21 ' HA ' ' A' ' 80' ' ' ILE . 25.9 mp0 63.76 39.64 8.33 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.12 0.486 . . . . 0.0 110.942 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.444 ' OD2' ' HB3' ' A' ' 49' ' ' PHE . 2.8 m-20 -100.8 169.51 8.95 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.532 -179.499 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.555 ' O ' HG22 ' A' ' 55' ' ' VAL . 8.7 pt-20 -66.48 -40.39 89.3 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.423 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.468 ' NH1' ' HG3' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -69.34 -8.7 48.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.658 0.266 . . . . 0.0 110.741 179.806 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.644 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -87.84 -35.99 17.47 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.584 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 52' ' ' GLU . 35.1 m -64.5 -39.57 86.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -178.003 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.653 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 3.6 tp10 -59.44 -54.2 58.37 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -178.641 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.653 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 80.1 Cg_exo -46.34 -52.11 7.76 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.297 1.998 . . . . 0.0 112.476 179.62 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.511 HD22 ' HA ' ' A' ' 73' ' ' ALA . 12.3 mt -53.65 -29.03 36.41 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.915 -179.14 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 46.0 mm -63.43 -60.73 2.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.43 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -70.1 -10.58 59.2 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -178.969 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.745 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.6 OUTLIER -83.02 -49.59 9.4 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.481 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.717 HD13 HD22 ' A' ' 92' ' ' LEU . 12.7 mt -56.39 -9.92 0.81 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.494 -179.311 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -123.78 -8.53 7.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.034 179.593 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.441 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 3.3 t70 -61.11 -38.83 87.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.074 0.464 . . . . 0.0 111.275 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.521 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 49.7 m-20 64.14 24.7 13.52 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.257 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.502 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 1.0 OUTLIER -83.91 7.64 17.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.291 -179.974 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.6 -78.32 0.73 Allowed Glycine 0 C--N 1.33 0.196 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.492 179.946 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -51.07 66.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.286 0.565 . . . . 0.0 109.969 179.422 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.745 HG12 ' HG ' ' A' ' 61' ' ' LEU . 21.8 t -62.63 -43.76 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.379 -179.8 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.521 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 37.8 ttp180 -66.77 -60.12 2.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.238 -179.686 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.0 m -51.51 -28.02 12.34 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.174 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -60.98 -46.01 95.44 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.184 179.702 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.511 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -66.96 -35.89 80.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.764 0.316 . . . . 0.0 111.085 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.17 -46.98 72.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.453 -179.691 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -78.88 -36.3 42.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.448 -179.688 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.521 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 58.8 m -59.37 -41.98 90.55 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.409 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.704 HD11 HD11 ' A' ' 62' ' ' LEU . 11.5 mt -61.1 -60.82 3.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.768 0.318 . . . . 0.0 110.718 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.451 ' HA ' ' CD1' ' A' ' 107' ' ' TYR . 34.0 mt-10 -53.77 -33.24 55.22 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.557 178.726 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -63.2 -42.48 99.33 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.853 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.786 ' HA ' HE21 ' A' ' 50' ' ' GLN . 91.7 mt -64.32 -60.39 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.21 179.117 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.59 133.32 0.05 OUTLIER Glycine 0 CA--C 1.518 0.251 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.881 179.782 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 133.39 164.36 10.76 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.586 179.822 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.4 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 12.7 pt-20 -65.19 -22.43 66.9 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.782 0.325 . . . . 0.0 110.738 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.638 ' HD3' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -60.57 -53.42 57.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 -179.998 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.638 ' N ' ' HD3' ' A' ' 84' ' ' ARG . 2.3 t -70.81 -26.14 27.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.053 0.454 . . . . 0.0 110.245 179.475 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.48 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 74.2 ttt180 -52.44 -31.9 36.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.756 -179.84 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.11 92.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.393 179.672 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.09 -35.94 78.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.219 179.34 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.668 ' HE1' HG12 ' A' ' 103' ' ' VAL . 8.2 mmm -67.8 -43.08 80.51 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.568 179.05 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 14.4 mm-40 -57.39 -36.4 71.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.724 178.494 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -75.89 -28.74 58.23 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.29 179.771 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.717 HD22 HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -87.16 -23.24 24.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.935 0.398 . . . . 0.0 110.428 179.817 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.15 -29.88 70.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.382 -179.843 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.516 ' HG3' HG23 ' A' ' 95' ' ' THR . 11.3 pt-20 -80.22 -23.23 41.04 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.975 0.417 . . . . 0.0 110.291 179.741 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.516 HG23 ' HG3' ' A' ' 94' ' ' GLU . 73.9 p -111.87 19.63 17.75 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.794 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.57 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -52.18 119.67 9.55 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 114.952 -1.022 . . . . 0.0 113.306 -179.201 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.3 t -144.1 130.35 19.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.813 0.339 . . . . 0.0 111.007 179.205 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.63 -131.01 50.74 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.902 179.936 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -77.36 -27.76 52.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.722 0.296 . . . . 0.0 111.278 -179.792 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.632 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -53.93 -31.42 50.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.68 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.57 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 47.8 ttt180 -75.31 -52.46 10.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.373 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -48.22 -22.0 0.59 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.268 0.556 . . . . 0.0 110.454 179.651 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.668 HG12 ' HE1' ' A' ' 89' ' ' MET . 49.1 t -69.05 -60.17 2.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.524 179.738 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.663 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.23 -46.97 84.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.179 0.514 . . . . 0.0 112.227 -179.596 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 59.5 t -64.88 -63.15 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -178.069 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -55.42 -37.3 67.48 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.199 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.585 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 22.9 t80 -61.5 -23.76 66.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.975 0.417 . . . . 0.0 111.421 -178.705 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 74.5 mt -58.1 -25.47 61.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.661 -179.478 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -85.38 0.45 52.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.522 -179.6 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 47.3 p -145.54 29.27 1.14 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -179.585 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.153 -0.927 . . . . 0.0 111.043 179.927 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.8 tpt . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.8 0.333 . . . . 0.0 110.794 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -113.88 1.59 14.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.288 -179.911 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -109.99 -62.72 1.47 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.821 179.901 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.16 150.39 48.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.791 179.895 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 43.3 t30 59.34 93.84 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.311 179.932 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -98.08 -32.89 11.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.882 179.934 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 58.4 m95 -75.61 83.67 2.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.669 179.915 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.616 ' HA ' ' HB2' ' A' ' 22' ' ' GLU . 1.6 p -177.41 -53.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.643 -179.613 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.455 ' H ' HG13 ' A' ' 8' ' ' VAL . 0.0 OUTLIER -107.85 21.74 16.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.172 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptp180 -59.95 108.7 0.8 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.998 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.2 t70 73.05 -0.85 3.24 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.333 -178.98 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.722 HG12 ' H ' ' A' ' 13' ' ' SER . 1.5 t -108.91 -165.91 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.207 179.743 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.722 ' H ' HG12 ' A' ' 12' ' ' VAL . 42.9 t -156.82 -69.65 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.739 0.304 . . . . 0.0 110.52 179.916 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.4 p -75.28 90.62 2.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.975 0.417 . . . . 0.0 110.253 179.32 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.674 ' HA ' ' HG3' ' A' ' 19' ' ' MET . . . -85.86 -60.75 1.92 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.063 -178.969 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.444 ' C ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -55.66 -13.85 1.87 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.88 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.49 ' O ' ' HB2' ' A' ' 18' ' ' ARG . 38.7 t -61.84 -52.75 62.87 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 121.115 -0.234 . . . . 0.0 111.111 -179.679 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 17' ' ' SER . 63.0 ttt180 169.65 92.32 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 O-C-N 123.574 0.546 . . . . 0.0 110.235 179.939 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.674 ' HG3' ' HA ' ' A' ' 15' ' ' ALA . 1.9 mmt -133.22 -28.22 1.52 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.077 -179.531 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.33 139.25 0.69 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.098 -179.515 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 66.68 -77.36 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.201 0.524 . . . . 0.0 110.751 -179.483 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.616 ' HB2' ' HA ' ' A' ' 8' ' ' VAL . 10.4 pt-20 -57.78 -32.62 67.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.156 179.834 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.637 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -87.94 -6.72 57.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.849 -179.221 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 8.9 t80 -59.14 -56.21 25.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.698 -179.693 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.439 ' O ' ' N ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.41 -51.26 69.08 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-O 119.216 -0.421 . . . . 0.0 111.724 179.979 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.637 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 59.8 Cg_exo -39.23 -29.65 0.22 Allowed 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 122.285 1.99 . . . . 0.0 111.254 179.174 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 25.9 mt -73.85 -55.18 6.52 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.726 -1.124 . . . . 0.0 109.339 177.882 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.52 HD22 HD12 ' A' ' 31' ' ' LEU . 3.0 tm? -53.33 -46.52 69.5 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.844 178.538 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -62.72 -41.87 99.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.738 179.931 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.558 ' HA ' ' HB2' ' A' ' 33' ' ' ASN . 47.4 t -66.37 -12.27 55.91 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.061 -179.278 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.52 HD12 HD22 ' A' ' 28' ' ' LEU . 49.0 mt -57.44 -24.3 54.78 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.915 0.388 . . . . 0.0 110.688 -179.774 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 71.3 p -125.8 21.81 7.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.628 179.723 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.558 ' HB2' ' HA ' ' A' ' 30' ' ' SER . 26.3 t-20 -57.36 141.22 47.86 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.074 -179.747 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.25 -43.51 96.07 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.731 -179.948 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -77.95 137.64 38.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.593 179.526 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 21.3 m95 -76.86 -29.79 56.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.146 -179.661 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -62.97 -45.29 93.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.875 179.902 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.6 mm -67.37 -36.06 75.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.766 179.771 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.609 HH12 HD21 ' A' ' 61' ' ' LEU . 1.3 tpm_? -64.9 -34.52 78.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.636 179.738 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.17 -64.46 2.99 Favored Glycine 0 C--N 1.33 0.204 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.751 -179.873 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.32 -33.91 9.68 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.732 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.576 ' HB3' HH21 ' A' ' 39' ' ' ARG . . . -63.64 -56.35 16.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.78 0.324 . . . . 0.0 110.782 179.967 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.27 -26.05 68.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.077 179.539 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 5.9 m95 -70.55 -39.72 73.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.526 -178.762 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.8 mt -98.88 -19.08 6.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.842 0.353 . . . . 0.0 111.868 -178.515 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.636 HD13 ' HG2' ' A' ' 57' ' ' PRO . 5.4 tt -53.9 -36.44 30.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.044 -178.996 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -70.27 -17.58 74.27 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.179 -179.551 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.559 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.9 OUTLIER -70.33 -7.26 41.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.703 0.251 . . . . 0.0 111.58 -179.486 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -94.15 -24.92 17.34 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.598 0.237 . . . . 0.0 111.476 -179.905 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.654 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.7 mp0 60.74 30.28 19.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.382 179.485 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.46 ' O ' HG23 ' A' ' 55' ' ' VAL . 11.2 t70 -102.67 162.27 13.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.733 179.844 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -61.35 -36.23 79.63 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.011 -179.829 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.412 ' HG3' HD23 ' A' ' 28' ' ' LEU . 35.0 ttm180 -67.33 -9.61 42.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.026 0.441 . . . . 0.0 110.457 179.634 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.92 -7.99 21.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.558 -179.795 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.46 HG23 ' O ' ' A' ' 51' ' ' ASP . 21.4 t -90.22 -35.2 7.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.005 -179.769 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.525 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 20.6 tt0 -60.16 -48.44 94.31 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.341 -179.926 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.636 ' HG2' HD13 ' A' ' 46' ' ' ILE . 83.7 Cg_exo -46.18 -48.44 13.04 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 122.341 2.027 . . . . 0.0 112.094 179.365 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.451 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 1.7 mt -56.04 -33.06 64.62 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.8 -179.468 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 39.8 mm -57.16 -60.8 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.066 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -38.29 75.16 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.974 0.416 . . . . 0.0 111.826 -179.488 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.708 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.6 mp -57.08 -49.37 76.07 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -178.389 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.565 ' HB3' HD22 ' A' ' 92' ' ' LEU . 34.5 mt -60.44 -9.58 3.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.272 0.558 . . . . 0.0 110.008 -179.672 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -117.58 -12.0 10.39 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.843 179.511 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.522 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 6.5 t70 -61.05 -48.37 82.06 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.233 0.54 . . . . 0.0 111.152 -179.499 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.477 ' HB2' ' NH2' ' A' ' 70' ' ' ARG . 20.3 t70 68.98 21.39 7.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.806 179.447 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.48 ' HB2' ' HB ' ' A' ' 69' ' ' VAL . 36.2 m -86.22 12.14 10.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.265 -179.785 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.3 -100.78 1.42 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.614 179.712 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -46.27 -36.61 6.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.155 0.502 . . . . 0.0 110.512 179.762 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.708 HG12 ' HG ' ' A' ' 61' ' ' LEU . 16.4 t -73.57 -47.23 45.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.989 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.477 ' NH2' ' HB2' ' A' ' 65' ' ' ASP . 14.0 ttm180 -71.75 -61.76 1.66 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.651 0.263 . . . . 0.0 111.542 -179.48 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 87.6 p -50.56 -31.16 14.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.341 -179.706 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -62.66 -39.42 97.9 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.734 179.919 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.451 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -73.49 -30.03 62.89 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.599 0.238 . . . . 0.0 111.363 -179.983 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -54.8 -46.22 74.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.643 -179.591 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 75' ' ' ARG . 7.1 ptp180 -79.28 -17.09 55.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.384 -179.716 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.0 t -63.82 -44.34 93.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.285 179.778 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.449 HD12 HD13 ' A' ' 58' ' ' LEU . 6.4 mp -58.95 -60.26 4.15 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.77 0.319 . . . . 0.0 111.138 179.997 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.402 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 3.7 tm-20 -50.92 -39.17 53.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.151 179.651 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -55.98 -38.37 70.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.339 -179.876 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.654 HG12 ' HG3' ' A' ' 50' ' ' GLN . 61.2 mt -86.95 -60.63 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.425 -179.767 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.82 93.81 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.512 -179.858 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.484 ' HA3' ' NH1' ' A' ' 84' ' ' ARG . . . 179.48 -174.16 45.96 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.779 -179.888 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -67.81 -31.93 72.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.891 0.376 . . . . 0.0 111.202 -179.7 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.549 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -60.44 -56.22 24.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.088 -179.814 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.549 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.6 OUTLIER -70.83 -20.69 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.839 0.352 . . . . 0.0 110.889 179.488 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.474 ' HD3' ' O ' ' A' ' 86' ' ' ARG . 2.2 tmt_? -55.81 -31.98 63.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.801 179.404 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.421 ' O ' ' HG3' ' A' ' 90' ' ' GLU . . . -76.99 -23.94 52.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.865 179.801 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.24 -44.68 64.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.749 179.676 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.529 ' SD ' ' N ' ' A' ' 90' ' ' GLU . 2.3 ppp? -71.93 -30.58 65.48 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.276 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.529 ' N ' ' SD ' ' A' ' 89' ' ' MET . 1.0 OUTLIER -75.91 -29.19 58.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.936 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -72.05 -30.62 65.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.907 178.851 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.764 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.4 OUTLIER -87.33 -31.8 19.98 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.285 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.49 -24.98 61.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.408 178.807 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.21 -26.58 39.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.12 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 68.0 p -121.54 27.6 8.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.43 179.024 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -54.09 125.12 32.51 Favored Glycine 0 N--CA 1.448 -0.539 0 CA-C-N 115.086 -0.961 . . . . 0.0 113.683 -178.822 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.1 t -150.25 130.34 13.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.897 0.379 . . . . 0.0 111.033 179.129 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 59.22 -146.92 42.71 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.895 179.895 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.13 -28.71 62.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.672 0.272 . . . . 0.0 111.404 -179.805 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.679 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -55.25 -53.84 50.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.704 -179.79 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 39.4 ttp180 -55.24 -61.04 2.59 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.249 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 23.5 ttpp -45.67 -30.59 1.6 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.484 -179.174 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.535 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 4.8 t -65.06 -59.08 4.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.715 -179.82 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.764 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -51.39 -60.4 3.18 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.293 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 92.2 t -57.96 -61.24 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.447 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.401 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 12.0 m120 -55.49 -29.73 59.34 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.804 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.402 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 5.2 t80 -60.28 -33.07 71.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.135 0.493 . . . . 0.0 110.499 -179.899 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.433 HD21 ' SD ' ' A' ' 89' ' ' MET . 74.5 mt -55.24 -13.43 1.31 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.865 -179.419 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.504 ' HG3' HG23 ' A' ' 110' ' ' THR . 9.0 pt-20 -78.42 5.22 11.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.553 -179.998 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.504 HG23 ' HG3' ' A' ' 109' ' ' GLU . 70.0 p -144.98 7.06 1.19 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.436 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.824 -179.993 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.737 0.303 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.16 -31.5 0.2 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.248 -179.905 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -145.01 7.63 1.21 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 -179.872 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -115.24 -67.27 1.01 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.821 179.945 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -97.4 102.67 14.48 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.734 179.75 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -135.12 -171.51 2.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.176 179.976 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 2.0 p90 32.49 87.73 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.554 0.534 . . . . 0.0 112.193 179.543 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.7 p -152.32 130.47 2.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.364 179.927 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 63.96 4.36 1.97 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.956 179.635 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.438 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 32.9 ptt180 -72.25 116.45 12.7 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.163 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.438 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 25.6 t70 77.03 -49.69 0.55 Allowed 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.995 -179.282 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.694 HG12 ' H ' ' A' ' 13' ' ' SER . 2.4 t -68.32 176.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.546 179.878 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.694 ' H ' HG12 ' A' ' 12' ' ' VAL . 78.6 p -156.84 -3.27 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.707 0.289 . . . . 0.0 110.963 179.893 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.637 ' HB ' ' HB3' ' A' ' 17' ' ' SER . 1.5 m -85.93 166.62 15.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.282 179.435 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.441 ' H ' HG22 ' A' ' 14' ' ' THR . . . -95.3 -67.85 0.83 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.402 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.5 mt -83.5 -13.96 53.45 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.079 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.637 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 43.6 t -58.78 -52.06 67.3 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.593 -179.257 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -177.42 117.57 0.1 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.792 0.329 . . . . 0.0 111.379 -179.528 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.539 ' HB2' ' H ' ' A' ' 23' ' ' ALA . 14.8 mmt -122.0 -13.0 8.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.438 179.177 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.77 -17.07 47.6 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.835 179.727 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -174.23 -41.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.835 0.35 . . . . 0.0 111.02 -179.766 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.503 ' HB3' ' HB3' ' A' ' 19' ' ' MET . 30.5 tt0 -62.77 -29.66 70.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.487 -179.592 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.539 ' H ' ' HB2' ' A' ' 19' ' ' MET . . . -100.68 -3.75 29.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.67 -179.614 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.09 -52.95 62.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 110.316 179.449 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -63.37 -54.98 39.56 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.19 179.703 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 43.7 Cg_exo -51.74 -19.49 7.94 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.754 1.636 . . . . 0.0 110.758 179.733 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.662 HD21 ' HA ' ' A' ' 46' ' ' ILE . 1.4 tp -87.05 -36.06 18.39 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.416 179.809 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.64 HD12 HD12 ' A' ' 31' ' ' LEU . 21.1 tp -81.94 -22.48 36.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.338 -179.942 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.452 ' HG2' ' HA ' ' A' ' 26' ' ' PRO . 0.7 OUTLIER -74.91 -32.25 61.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.864 0.364 . . . . 0.0 110.998 -179.407 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 93.7 p -66.44 -20.05 65.95 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.41 -179.872 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.64 HD12 HD12 ' A' ' 28' ' ' LEU . 81.4 mt -66.19 -7.83 20.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.263 -179.824 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 98.2 p -106.91 21.82 16.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.826 179.769 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -84.7 142.99 29.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.08 -179.918 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -67.19 -17.53 64.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.597 179.746 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -86.36 156.63 20.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.659 179.835 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.9 p-90 -100.66 -34.29 9.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.427 -179.53 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -64.82 -44.74 88.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.774 0.321 . . . . 0.0 111.098 -179.901 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.4 mt -63.8 -42.92 97.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.717 -179.896 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -63.99 -21.63 66.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.553 179.765 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.12 -61.09 7.01 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.508 179.856 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.75 -34.77 28.49 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.737 0.303 . . . . 0.0 111.211 179.832 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.5 -56.72 18.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.709 179.729 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.37 -32.69 72.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.56 179.426 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.8 m95 -70.7 -29.33 65.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.466 -179.313 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.1 mt -99.02 -25.04 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-O 120.931 0.395 . . . . 0.0 111.574 -179.06 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.662 ' HA ' HD21 ' A' ' 27' ' ' LEU . 2.8 tt -60.55 -28.13 41.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.502 -178.792 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.569 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -66.23 -26.1 72.48 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.489 179.777 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.545 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER -53.14 -39.65 63.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.398 . . . . 0.0 110.159 179.615 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -87.54 119.58 27.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.275 179.203 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.417 ' HG2' HG23 ' A' ' 80' ' ' ILE . 51.8 mt-30 -81.79 24.99 0.57 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.674 -179.948 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -83.94 163.09 20.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.096 -179.8 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.45 -25.97 66.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.183 -179.805 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.436 ' HD3' HD22 ' A' ' 28' ' ' LEU . 18.7 ttm180 -68.12 -12.81 61.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.759 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.57 -4.47 21.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.919 -179.374 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.5 t -83.76 -40.09 15.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.916 -179.091 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 2.1 tm-20 -60.21 -49.61 89.93 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 -179.643 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.496 ' HG2' HD13 ' A' ' 46' ' ' ILE . 92.8 Cg_exo -43.72 -52.3 5.45 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 122.244 1.963 . . . . 0.0 112.083 179.229 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 24.5 mt -49.82 -37.14 29.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.394 -0.821 . . . . 0.0 112.197 -179.81 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 44.7 mm -61.0 -62.09 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.07 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.423 ' HG3' HD13 ' A' ' 61' ' ' LEU . 5.3 pttt -72.71 -6.58 45.5 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.934 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.705 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.5 mp -89.03 -46.45 8.85 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -178.322 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.801 HD13 HD22 ' A' ' 92' ' ' LEU . 10.0 mt -60.76 -10.01 4.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.14 0.495 . . . . 0.0 110.377 -179.277 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -115.46 -14.98 11.54 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.146 -179.655 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -61.13 -31.59 71.3 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.124 0.488 . . . . 0.0 111.284 179.925 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.495 ' HA ' ' HG3' ' A' ' 70' ' ' ARG . 55.6 m-20 51.58 28.08 4.4 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.039 179.912 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 33.0 t -86.33 7.13 26.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.683 0.278 . . . . 0.0 111.27 179.903 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.59 -96.02 1.73 Allowed Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.296 -179.89 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -50.33 -43.63 54.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.128 0.49 . . . . 0.0 110.15 179.524 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.705 HG12 ' HG ' ' A' ' 61' ' ' LEU . 11.8 t -73.62 -46.23 48.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.864 -179.806 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.495 ' HG3' ' HA ' ' A' ' 65' ' ' ASP . 4.3 tmm_? -66.09 -64.03 0.95 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.549 -179.091 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 68.9 m -54.39 -27.1 34.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.608 179.827 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.6 -46.46 88.57 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.64 -0.79 . . . . 0.0 111.936 179.57 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' ' 77' ' ' LEU . . . -59.19 -56.09 26.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.581 0.229 . . . . 0.0 111.14 179.774 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -51.79 -27.0 10.87 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.07 0.462 . . . . 0.0 110.883 -179.562 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 34.8 ttt85 -80.31 -40.04 27.54 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.916 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.569 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 0.0 OUTLIER -67.08 -35.24 79.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.2 -178.966 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.474 HD12 ' O ' ' A' ' 73' ' ' ALA . 3.5 mp -56.68 -59.06 5.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.654 0.264 . . . . 0.0 111.092 -179.663 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.442 ' HA ' ' CE1' ' A' ' 107' ' ' TYR . 44.7 mt-10 -49.0 -27.15 2.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.804 179.817 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.4 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 68.4 mt-30 -70.73 -43.61 68.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.779 0.323 . . . . 0.0 111.501 -179.86 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.417 HG23 ' HG2' ' A' ' 50' ' ' GLN . 46.7 mt -70.06 -61.28 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.8 -179.12 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 53.14 89.52 0.01 OUTLIER Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.498 -179.716 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.448 ' H ' ' CG1' ' A' ' 85' ' ' VAL . . . 178.33 -173.45 45.88 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.607 -179.623 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.436 ' O ' ' HB2' ' A' ' 86' ' ' ARG . 4.9 tm-20 -72.24 -25.8 61.77 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.781 0.324 . . . . 0.0 111.181 -179.691 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.551 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -70.0 -50.72 38.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.984 0.421 . . . . 0.0 110.499 179.839 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.551 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 11.5 p -70.66 -25.69 26.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.434 179.132 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.593 ' NH2' ' HA ' ' A' ' 108' ' ' LEU . 1.1 mmp_? -47.12 -40.08 14.74 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.152 179.635 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.11 -30.92 71.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.443 -179.389 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.36 -55.42 33.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.81 -179.796 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.492 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.3 -25.86 65.35 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.198 -179.389 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 42.5 mt-10 -73.02 -34.37 66.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.97 0.414 . . . . 0.0 109.995 179.133 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -78.92 -24.9 43.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.427 179.111 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.801 HD22 HD13 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -87.63 -30.19 20.64 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.203 179.323 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.27 -29.97 67.96 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.147 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.07 -26.57 39.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.15 0.5 . . . . 0.0 109.692 179.339 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.8 p -107.59 21.24 17.75 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.608 178.524 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.617 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -46.48 108.53 0.27 Allowed Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.124 -0.943 . . . . 0.0 112.751 -179.431 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.441 ' O ' ' HB3' ' A' ' 100' ' ' ALA . 33.1 p -139.75 129.36 24.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.732 0.301 . . . . 0.0 110.727 -179.882 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 55.38 -145.02 32.11 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.858 -179.879 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -58.92 -30.46 67.86 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.715 0.293 . . . . 0.0 111.161 179.975 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.631 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -52.19 -42.59 63.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.852 -179.615 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.617 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 43.2 ttt180 -66.5 -55.6 14.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.676 0.274 . . . . 0.0 111.623 -179.535 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.2 tptp -46.05 -25.13 0.52 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.593 179.915 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.519 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 21.3 t -71.83 -58.43 5.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.912 -179.868 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.541 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -51.35 -60.88 2.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.819 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.522 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 21.8 t -56.58 -47.9 81.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -178.04 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -71.01 -35.01 71.89 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -179.52 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.514 ' OH ' HG11 ' A' ' 85' ' ' VAL . 14.1 t80 -64.11 -46.96 81.91 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.292 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.593 ' HA ' ' NH2' ' A' ' 86' ' ' ARG . 3.0 pp -55.34 -10.85 0.66 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.187 -178.882 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -89.11 6.96 37.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.52 0.2 . . . . 0.0 111.467 179.735 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.5 p -129.81 -66.54 0.79 Allowed 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.792 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.521 ' HB3' HH22 ' A' ' 86' ' ' ARG . 21.4 p80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 117.949 -1.024 . . . . 0.0 111.331 -179.266 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.4 mmt . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 120.908 0.385 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.02 117.49 19.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.229 179.968 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.3 t70 61.79 105.58 0.02 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.162 -179.932 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.435 ' HG2' ' N ' ' A' ' 5' ' ' ASN . 35.6 tt0 63.34 162.16 0.1 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.019 179.943 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.435 ' N ' ' HG2' ' A' ' 4' ' ' GLU . 2.6 t-20 60.33 19.81 9.35 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.005 179.895 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -90.09 -70.86 0.65 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.85 179.968 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -6.18 29.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.366 -179.892 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 72.1 t -66.36 -24.93 34.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.263 -179.876 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.572 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 70.9 ttt180 -147.49 -5.66 0.48 Allowed 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.702 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 ttp180 -58.54 103.36 0.15 Allowed 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 177.643 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.9 t70 59.92 37.51 21.52 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -177.268 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.572 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 4.6 p -31.57 -51.38 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.635 -178.684 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.47 ' N ' HG13 ' A' ' 12' ' ' VAL . 18.1 t 62.06 -84.11 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.207 178.749 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.56 HG22 ' H ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -114.87 -161.17 0.76 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.656 179.812 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.56 ' H ' HG22 ' A' ' 14' ' ' THR . . . -95.21 -67.36 0.86 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.462 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.429 ' H ' ' HG ' ' A' ' 16' ' ' LEU . 1.9 pp -85.68 -12.81 50.31 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.007 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.415 ' N ' HD12 ' A' ' 16' ' ' LEU . 38.4 m -52.43 -34.16 47.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -179.06 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -140.81 -73.21 0.34 Allowed 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -179.167 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.541 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 14.3 ptm -48.46 -41.33 29.25 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.936 -178.621 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' A' ' 22' ' ' GLU . . . 50.7 -142.96 14.6 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.002 -179.652 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.1 t70 58.72 -80.2 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.648 0.261 . . . . 0.0 111.228 179.719 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 20' ' ' GLY . 0.8 OUTLIER -65.18 -17.44 64.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.988 0.423 . . . . 0.0 110.228 179.165 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.33 11.21 33.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.795 179.437 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.638 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.4 t80 -63.53 -45.28 91.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.444 179.95 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.446 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 24.2 mt-10 -63.37 -55.63 33.97 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.018 -179.653 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 9.4 Cg_endo -54.93 -16.1 11.2 Favored 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 121.74 1.626 . . . . 0.0 110.704 179.344 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.44 ' HB3' ' O ' ' A' ' 24' ' ' PHE . 1.0 OUTLIER -85.62 -34.31 21.43 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.461 -1.245 . . . . 0.0 108.881 178.842 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.491 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -77.32 -39.26 48.4 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.988 178.869 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -64.52 -37.14 86.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.214 -179.308 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 89.4 p -66.33 -14.56 62.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.945 -179.172 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.45 HD12 HD13 ' A' ' 28' ' ' LEU . 96.5 mt -60.15 -29.15 68.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.747 0.308 . . . . 0.0 111.154 -179.893 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.9 m -92.46 20.88 5.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.374 -179.667 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.764 HD21 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -75.3 150.56 38.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.851 179.995 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -67.05 -20.7 65.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.304 -179.807 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.423 ' HB2' ' OD1' ' A' ' 33' ' ' ASN . 7.5 m-20 -78.65 162.98 25.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.893 0.378 . . . . 0.0 111.052 -179.821 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -104.57 -44.43 4.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.829 -179.7 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.506 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 71.4 mtp85 -58.83 -58.36 8.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.663 -179.703 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.467 ' HB ' ' OD1' ' A' ' 33' ' ' ASN . 71.1 mt -50.05 -40.6 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.496 -179.582 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.764 ' HB2' HD21 ' A' ' 33' ' ' ASN . 43.1 ttp180 -64.41 -40.22 95.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.012 179.896 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -59.8 -58.86 12.0 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.285 179.952 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.66 -28.81 6.34 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.683 0.278 . . . . 0.0 111.173 179.675 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 39' ' ' ARG . . . -59.24 -56.37 23.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.721 179.702 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.61 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -64.24 -32.47 74.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.611 179.445 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.418 ' NE1' ' HD1' ' A' ' 68' ' ' PHE . 12.6 m95 -55.72 -32.02 62.98 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.959 179.926 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.483 ' HA ' HD22 ' A' ' 48' ' ' ASN . 50.9 mm -98.51 -24.52 4.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.61 179.507 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.61 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 5.6 mm -55.43 -44.59 76.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.654 -179.979 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.34 -22.75 59.15 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.796 -0.716 . . . . 0.0 113.214 -179.397 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.483 HD22 ' HA ' ' A' ' 45' ' ' ILE . 44.1 m-80 -68.42 -40.55 81.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.81 0.305 . . . . 0.0 111.445 -179.797 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -97.15 112.22 24.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.718 0.294 . . . . 0.0 110.452 -179.929 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.73 ' H ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -77.22 58.14 1.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.767 179.762 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -102.7 172.69 6.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.935 -179.526 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -66.25 -45.47 80.44 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.876 -179.307 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -6.92 13.26 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.244 -0.183 . . . . 0.0 111.118 179.893 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.638 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -95.65 8.92 42.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.011 0.434 . . . . 0.0 111.042 -178.752 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 45.4 t -92.01 -59.11 3.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.558 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.415 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 27.3 tt0 -60.29 -49.64 89.63 Favored Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.495 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.47 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 58.4 Cg_exo -38.23 -44.88 2.06 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.709 2.273 . . . . 0.0 113.391 -179.088 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.609 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 8.0 mt -62.55 -54.05 45.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.321 -179.369 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.416 ' HA ' HD12 ' A' ' 62' ' ' LEU . 83.1 mt -50.53 -53.95 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.048 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.426 ' H ' ' HG3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -70.16 -24.27 63.13 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -177.956 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.586 ' HG ' HG12 ' A' ' 69' ' ' VAL . 3.7 tp -90.13 -20.0 23.63 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -178.716 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.668 HD13 HD11 ' A' ' 92' ' ' LEU . 6.3 mt -69.5 -12.59 61.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.937 0.399 . . . . 0.0 110.635 -179.916 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -112.68 1.73 15.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.978 -179.893 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -61.15 -30.35 70.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.165 0.507 . . . . 0.0 110.642 179.759 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.544 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 26.3 m-20 48.63 27.6 1.54 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.135 -0.939 . . . . 0.0 112.279 179.628 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.49 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 38.6 t -86.32 -15.06 41.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.765 0.316 . . . . 0.0 110.677 179.808 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 118.0 -109.94 1.9 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.504 179.784 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.506 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -59.15 -25.42 63.87 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.659 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.586 HG12 ' HG ' ' A' ' 61' ' ' LEU . 41.4 t -71.18 -32.29 47.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.645 178.61 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.544 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 52.8 ttp180 -78.7 -44.39 23.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.698 179.422 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.457 ' HA ' ' HZ ' ' A' ' 99' ' ' PHE . 28.9 t -67.09 -41.73 85.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.452 -179.83 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -51.18 -45.83 51.6 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.417 -179.79 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.609 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -71.75 -31.79 67.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.649 0.262 . . . . 0.0 111.048 179.68 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.636 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -60.17 -54.22 48.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.755 -179.224 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -61.88 -27.5 68.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.328 -179.645 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.443 ' HB2' HD22 ' A' ' 58' ' ' LEU . 50.4 m -58.87 -33.98 71.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.127 -179.831 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.611 HD11 HD11 ' A' ' 62' ' ' LEU . 9.1 mp -61.25 -60.64 3.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.89 0.376 . . . . 0.0 110.441 179.455 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -55.84 -24.95 39.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.295 178.909 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.419 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 37.8 mt-30 -70.73 -50.91 31.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.741 179.767 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.544 ' HB ' HG21 ' A' ' 85' ' ' VAL . 74.3 mt -66.03 -60.79 2.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.057 -179.984 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 66.64 127.46 0.02 OUTLIER Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.621 179.913 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 145.06 178.04 20.33 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.848 179.775 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.53 -34.35 78.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.846 0.355 . . . . 0.0 110.714 -179.99 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.51 ' H ' ' CD ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.72 -47.82 81.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.942 -179.881 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.544 HG21 ' HB ' ' A' ' 80' ' ' ILE . 33.1 t -70.56 -26.33 28.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.419 . . . . 0.0 110.648 179.654 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -58.61 -23.13 58.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.671 -179.895 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.9 -27.97 26.26 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.193 0.52 . . . . 0.0 109.771 179.434 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.98 -40.03 83.2 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.213 179.049 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.723 ' HE1' HD11 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -70.2 -36.96 74.95 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.656 179.181 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -57.86 -32.72 67.94 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.623 178.876 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.8 tmtm? -64.56 -52.65 56.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.736 179.57 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.668 HD11 HD13 ' A' ' 62' ' ' LEU . 54.4 mt -61.83 -37.59 85.01 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.717 0.294 . . . . 0.0 110.712 -179.915 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.414 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -54.58 -31.03 56.06 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.179 0.514 . . . . 0.0 110.282 179.485 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -86.66 -21.93 26.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.013 179.425 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.2 p -118.01 38.15 3.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.122 -179.869 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.417 ' HA2' ' HB2' ' A' ' 101' ' ' ARG . . . -39.4 109.36 0.11 Allowed Glycine 0 C--N 1.334 0.448 0 CA-C-N 116.092 -0.504 . . . . 0.0 113.198 -179.78 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.1 t -151.88 138.55 18.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.834 0.349 . . . . 0.0 111.459 -179.888 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 55.09 -139.24 41.35 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.81 179.673 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.457 ' HZ ' ' HA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -94.76 -13.97 25.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.843 0.354 . . . . 0.0 110.6 -179.903 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.426 ' O ' ' HB ' ' A' ' 103' ' ' VAL . . . -56.37 -35.02 67.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.829 179.824 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.417 ' HB2' ' HA2' ' A' ' 96' ' ' GLY . 11.0 tpt180 -61.74 -60.27 3.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.335 179.486 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.518 ' HG3' ' ND2' ' A' ' 106' ' ' ASN . 32.2 ttpt -51.55 -32.62 28.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.022 179.277 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.426 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 22.7 t -64.57 -46.87 91.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.97 179.484 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.549 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -61.49 -51.92 66.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.977 -179.562 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 59.9 t -63.62 -60.9 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.273 -179.022 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.518 ' ND2' ' HG3' ' A' ' 102' ' ' LYS . 17.3 m-80 -57.26 -30.08 64.36 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.744 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.03 -29.44 67.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.165 0.507 . . . . 0.0 110.039 -179.892 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.723 HD11 ' HE1' ' A' ' 89' ' ' MET . 98.0 mt -55.61 -25.29 37.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.011 179.582 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -51.26 -34.97 35.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.9 p -95.99 -57.0 2.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.329 179.994 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.959 179.993 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.4 ttp . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.866 0.365 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.54 112.76 14.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.979 179.926 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 57.87 85.26 0.09 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.83 -179.994 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -152.29 -63.6 0.17 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.612 -179.871 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -127.3 112.21 14.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.679 179.731 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -83.27 21.58 1.11 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.328 -179.814 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 17.9 p-90 -137.67 20.6 2.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 65.9 t -133.61 -32.44 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.816 179.742 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.526 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 8.6 ptm180 -96.47 -0.84 48.48 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.925 179.704 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.505 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 47.8 ttp180 -65.37 105.43 1.15 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.638 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.631 ' HB2' ' HG2' ' A' ' 18' ' ' ARG . 16.1 m-20 74.18 1.84 3.99 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.048 -179.404 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.526 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 2.6 p -59.67 142.6 14.91 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.191 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.599 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.49 ' HB2' ' O ' ' A' ' 12' ' ' VAL . 36.5 t 175.29 -40.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.834 -179.607 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.578 HG22 ' H ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -106.39 -162.31 0.85 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.184 179.433 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.578 ' H ' HG22 ' A' ' 14' ' ' THR . . . -93.28 -68.99 0.77 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.459 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -87.59 -15.77 36.43 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.51 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.3 t -53.09 -51.89 60.38 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.731 -179.108 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.631 ' HG2' ' HB2' ' A' ' 11' ' ' ASP . 17.9 tpp85 -172.87 118.92 0.34 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.848 0.356 . . . . 0.0 111.308 -179.86 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.402 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 95.2 mmm -133.33 -27.41 1.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.54 179.422 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 102.1 -54.12 0.77 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.767 179.661 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -141.24 -21.65 0.76 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.626 0.251 . . . . 0.0 111.499 -179.61 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 19' ' ' MET . 30.0 mm-40 -77.5 -28.23 52.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.438 -179.635 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.408 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -104.84 -7.81 19.15 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.54 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.472 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.3 t80 -60.93 -48.01 83.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.24 -179.917 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.411 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.49 -55.26 36.61 Favored Pre-proline 0 C--N 1.33 -0.249 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.238 179.775 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.411 ' HD3' ' HG3' ' A' ' 25' ' ' GLU . 52.5 Cg_exo -49.73 -26.34 13.12 Favored 'Trans proline' 0 C--N 1.357 1.019 0 C-N-CA 121.726 1.617 . . . . 0.0 110.458 179.022 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.52 HD11 HD12 ' A' ' 46' ' ' ILE . 0.2 OUTLIER -76.93 -42.51 39.08 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.554 179.186 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 31' ' ' LEU . 11.7 tp -76.16 -17.15 59.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.04 178.937 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -74.53 -32.16 62.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.744 -179.79 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.482 ' HA ' ' ND2' ' A' ' 33' ' ' ASN . 71.6 m -66.41 -22.48 66.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.235 -179.779 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.684 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 93.6 mt -67.01 -9.54 40.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.81 0.338 . . . . 0.0 110.851 179.942 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.4 t -112.42 19.57 17.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.8 179.853 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.482 ' ND2' ' HA ' ' A' ' 30' ' ' SER . 77.0 m-20 -89.82 147.53 23.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.212 -179.974 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -66.23 -23.05 66.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.772 179.835 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -78.01 149.18 34.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.935 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.6 p90 -93.28 -38.45 11.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.861 180.0 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.433 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 72.9 mtt-85 -60.4 -54.08 49.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.314 179.693 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 25.3 mm -54.57 -40.88 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.589 -179.359 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.684 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 39.7 ttm180 -65.46 -27.34 68.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.381 -179.774 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.533 ' HA2' HG13 ' A' ' 69' ' ' VAL . . . -64.4 -63.0 4.61 Favored Glycine 0 N--CA 1.453 -0.183 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.546 -179.782 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -46.57 -22.69 0.3 Allowed 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 179.995 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.431 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -58.5 -57.31 13.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.727 0.298 . . . . 0.0 110.924 179.85 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.97 -24.89 66.1 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.922 0.392 . . . . 0.0 110.805 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -61.85 -39.2 91.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.394 -179.925 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 33.5 mm -100.93 -21.62 5.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-O 120.831 0.348 . . . . 0.0 111.8 -179.521 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.52 HD12 HD11 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -54.52 -38.01 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.265 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -74.3 -20.6 79.6 Favored Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 120.507 -0.854 . . . . 0.0 113.205 -178.979 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.8 -0.8 9.77 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.383 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.432 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 91.0 m-85 -103.68 -34.01 8.76 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.716 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 49' ' ' PHE . 16.8 mt-30 67.31 57.27 0.59 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.245 0.545 . . . . 0.0 110.976 179.9 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -128.26 164.72 21.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.041 -179.803 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -65.48 -32.48 74.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.149 0.5 . . . . 0.0 110.098 179.355 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -69.3 -9.65 54.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.806 179.81 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.494 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -104.68 2.16 30.18 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.997 -179.378 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.2 t -86.57 -47.72 16.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.444 -179.416 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.492 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 23.2 tt0 -60.35 -47.76 95.67 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.788 -179.838 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 98.7 Cg_exo -43.68 -42.7 11.56 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.589 2.193 . . . . 0.0 113.002 -179.622 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.618 HD13 HD12 ' A' ' 77' ' ' LEU . 11.3 mt -64.66 -39.79 94.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.057 -179.874 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.423 HD11 ' HB1' ' A' ' 88' ' ' ALA . 47.6 mm -54.57 -57.66 5.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.981 -179.564 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.2 tmmm? -70.07 -28.46 65.45 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -178.353 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.538 ' HB3' ' HB2' ' A' ' 73' ' ' ALA . 4.7 tp -89.62 -21.39 22.83 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -177.521 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.749 HD13 HD22 ' A' ' 92' ' ' LEU . 22.4 mt -67.19 -20.81 65.77 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.584 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -92.41 -11.38 35.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.676 178.764 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.412 ' OD2' ' HB ' ' A' ' 69' ' ' VAL . 11.9 t70 -52.27 145.76 10.38 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.883 -178.523 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -118.29 27.0 9.23 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.021 -179.836 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.537 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 27.0 t -86.44 -36.38 19.13 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.898 -179.903 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 126.76 -96.72 0.47 Allowed Glycine 0 N--CA 1.452 -0.263 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.921 -179.603 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.433 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -61.48 -26.97 68.25 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.104 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.537 ' HB ' ' HB3' ' A' ' 66' ' ' SER . 32.2 t -67.95 -36.48 75.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.106 178.999 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -74.04 -55.3 6.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.358 179.549 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 36.8 t -59.07 -25.76 64.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.929 179.833 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -56.59 -45.6 89.87 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.367 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.538 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . . . -70.04 -30.28 67.52 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.863 0.363 . . . . 0.0 110.674 179.664 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 77' ' ' LEU . . . -61.75 -53.04 61.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.897 -179.439 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -66.22 -22.53 66.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.682 -179.152 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.574 ' HA ' HE21 ' A' ' 79' ' ' GLN . 40.4 t -58.59 -32.84 69.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.488 -179.645 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.618 HD12 HD13 ' A' ' 58' ' ' LEU . 7.2 mp -55.38 -62.27 1.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.503 -179.82 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.461 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 42.2 mt-10 -55.42 -32.84 63.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.255 179.563 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.574 HE21 ' HA ' ' A' ' 76' ' ' SER . 22.7 mt-30 -70.7 -27.17 63.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.165 -179.961 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 76' ' ' SER . 96.7 mt -83.16 -59.02 3.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.769 -179.284 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.645 ' HA3' ' HD3' ' A' ' 84' ' ' ARG . . . -179.56 -116.37 0.51 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.034 -1.079 . . . . 0.0 113.411 -179.516 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.454 ' O ' ' HB2' ' A' ' 86' ' ' ARG . . . -157.91 -71.02 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 121.208 -0.52 . . . . 0.0 112.022 -179.972 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.419 ' HG3' ' NH2' ' A' ' 86' ' ' ARG . 43.1 tt0 -72.24 -21.83 61.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.864 0.364 . . . . 0.0 111.244 -179.922 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.645 ' HD3' ' HA3' ' A' ' 81' ' ' GLY . 0.0 OUTLIER -75.58 -56.97 4.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.206 -178.912 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' ' SD ' ' A' ' 89' ' ' MET . 0.4 OUTLIER -68.3 -29.94 46.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.413 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 33.1 ttp180 -41.83 -35.05 0.74 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.921 -179.401 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.83 -49.37 75.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.872 0.368 . . . . 0.0 110.764 -179.877 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.423 ' HB1' HD11 ' A' ' 59' ' ' ILE . . . -69.44 -34.54 74.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.859 179.588 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.617 ' HG3' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -60.64 -48.45 81.71 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.18 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 46.7 mt-10 -56.13 -35.6 67.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.425 178.051 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -76.54 -25.86 54.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.979 179.753 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.813 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.9 OUTLIER -84.46 -24.98 29.26 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.774 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.71 -28.05 68.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.894 178.904 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -80.24 -25.66 39.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.258 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.8 p -109.42 17.18 21.72 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.433 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.534 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -54.49 116.82 6.89 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 114.7 -1.136 . . . . 0.0 113.311 -179.079 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.3 t -142.41 132.14 24.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.861 0.362 . . . . 0.0 110.958 179.258 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 56.26 -124.72 35.51 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.559 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.574 ' O ' HG23 ' A' ' 103' ' ' VAL . 68.5 t80 -79.91 -29.99 39.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.881 0.372 . . . . 0.0 110.37 179.583 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.587 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -50.79 -36.11 35.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.483 179.837 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.534 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 23.4 ttt180 -70.4 -61.11 1.9 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.655 -179.535 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -47.8 -22.27 0.52 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.238 -179.492 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 99' ' ' PHE . 39.2 t -63.53 -60.27 3.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.792 -179.916 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.813 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -57.99 -62.35 1.88 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.224 0.535 . . . . 0.0 112.431 -179.203 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.537 HG13 ' H ' ' A' ' 106' ' ' ASN . 3.1 p -52.68 -56.81 5.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.227 -0.897 . . . . 0.0 113.267 -178.294 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.537 ' H ' HG13 ' A' ' 105' ' ' VAL . 55.1 t30 -59.97 -35.38 74.87 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -178.813 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.582 ' HD2' ' HG2' ' A' ' 89' ' ' MET . 30.2 t80 -61.8 -25.48 67.52 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.98 0.419 . . . . 0.0 110.688 -179.323 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 99.3 mt -58.95 -13.18 5.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.592 179.694 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -64.98 -7.24 10.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.604 179.84 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 73.0 p -93.12 -49.82 5.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.648 179.64 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.884 179.486 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.792 0.329 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 56.72 -91.42 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.482 179.968 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.408 ' H ' ' H ' ' A' ' 4' ' ' GLU . 14.5 t70 -166.3 -17.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.66 -179.975 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.408 ' H ' ' H ' ' A' ' 3' ' ' ASP . 12.4 pt-20 -57.34 -27.76 62.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.967 179.967 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.506 ' C ' ' H ' ' A' ' 7' ' ' TRP . 26.9 t-20 -82.37 -91.98 0.07 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.964 -179.864 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt 67.39 -15.57 0.17 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.553 -179.89 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.506 ' H ' ' C ' ' A' ' 5' ' ' ASN . 95.1 m95 -113.54 -143.27 0.39 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.452 -179.992 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.423 ' C ' ' H ' ' A' ' 10' ' ' ARG . 0.4 OUTLIER 67.75 144.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 120.855 0.359 . . . . 0.0 111.26 -179.996 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.575 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 33.1 ttp180 72.46 -26.12 0.18 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.573 179.905 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.486 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 57.0 mtp180 -67.46 119.95 13.12 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 177.763 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.486 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 23.8 m-20 70.38 17.36 6.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.069 0.461 . . . . 0.0 110.104 -178.688 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.575 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 9.9 p -55.18 164.71 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.215 -179.766 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.46 ' N ' HG22 ' A' ' 12' ' ' VAL . 30.3 t 69.85 -1.88 2.2 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.627 179.187 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 82.4 p -142.28 11.73 1.95 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.006 0.431 . . . . 0.0 110.747 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' A' ' 23' ' ' ALA . . . -94.91 -10.02 32.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.23 -179.768 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.607 ' HA ' ' HB1' ' A' ' 23' ' ' ALA . 73.2 mt -54.44 -16.18 2.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.34 -179.256 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 67.8 m -48.5 -52.29 23.12 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.581 0.229 . . . . 0.0 110.986 -179.826 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.409 ' H ' ' H ' ' A' ' 19' ' ' MET . 0.0 OUTLIER 167.82 21.3 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.464 179.607 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 15' ' ' ALA . 12.5 mtt -61.25 -20.82 63.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.438 -179.468 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.87 -123.67 7.85 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.661 -0.781 . . . . 0.0 113.184 179.218 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -57.81 -39.0 76.55 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.752 0.31 . . . . 0.0 111.087 -179.694 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -60.9 -15.7 33.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.614 179.769 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.607 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -105.01 -15.35 15.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.711 -179.51 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.474 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 1.9 t80 -57.99 -52.38 65.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.717 -179.028 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.46 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 2.8 mt-10 -62.63 -57.17 23.63 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.674 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 13.9 Cg_endo -57.41 -12.03 9.82 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 122.112 1.875 . . . . 0.0 111.892 -179.729 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.636 HD21 ' HA ' ' A' ' 46' ' ' ILE . 1.9 tp -84.89 -44.3 13.31 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.96 179.899 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.438 ' H ' ' HG ' ' A' ' 28' ' ' LEU . 3.1 pp -84.34 -16.34 43.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.693 178.733 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -71.76 -31.38 66.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.086 179.566 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 t -66.35 -19.09 65.71 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.122 179.986 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 57' ' ' PRO . 91.5 mt -57.14 -16.77 8.49 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.856 0.36 . . . . 0.0 111.03 -179.926 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 74.6 m -94.7 23.46 5.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.224 -179.94 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.553 HD21 ' HB2' ' A' ' 39' ' ' ARG . 2.2 p30 -85.37 147.48 26.49 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.819 0.342 . . . . 0.0 110.583 -179.728 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -66.95 -25.89 66.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.143 -178.885 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -82.72 163.54 21.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.836 0.35 . . . . 0.0 111.082 -179.798 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.7 p-90 -101.75 -35.68 8.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.141 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.512 ' HA ' ' HE2' ' A' ' 68' ' ' PHE . 67.9 ttt180 -62.78 -29.74 70.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.35 -179.78 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 60.1 mt -76.5 -48.98 25.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.785 0.326 . . . . 0.0 111.256 -179.793 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.553 ' HB2' HD21 ' A' ' 33' ' ' ASN . 31.5 ttm180 -55.69 -27.83 52.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.254 -179.715 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.689 ' HA2' HD21 ' A' ' 61' ' ' LEU . . . -67.68 -55.68 13.78 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.744 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.13 -29.67 14.18 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.774 0.321 . . . . 0.0 111.245 179.793 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.564 ' O ' HD11 ' A' ' 27' ' ' LEU . . . -57.73 -54.37 47.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.851 179.797 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.542 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -68.43 -29.3 67.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.008 179.943 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.419 ' CD1' ' HA3' ' A' ' 72' ' ' GLY . 6.6 m95 -59.94 -38.04 81.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.626 -179.899 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 43.1 mm -98.87 -19.49 5.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.837 0.351 . . . . 0.0 111.718 -179.776 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.672 HG23 ' HB1' ' A' ' 54' ' ' ALA . 0.2 OUTLIER -52.74 -44.03 46.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.009 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -75.97 -13.51 83.09 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.69 -0.767 . . . . 0.0 113.701 -178.748 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.537 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.9 OUTLIER -70.77 -3.5 19.11 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 -179.37 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -99.59 -30.4 12.15 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.27 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.467 ' HG3' HG13 ' A' ' 80' ' ' ILE . 1.1 tt0 71.0 51.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.135 0.493 . . . . 0.0 111.029 179.284 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -127.45 155.71 43.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.13 -179.97 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.576 ' O ' HG22 ' A' ' 55' ' ' VAL . 0.4 OUTLIER -63.51 -30.3 71.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.664 179.734 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -69.22 -10.11 56.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.96 179.738 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.672 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -94.54 11.96 29.08 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -179.032 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.576 HG22 ' O ' ' A' ' 52' ' ' GLU . 23.0 m -91.68 -42.15 13.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.359 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.592 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 6.5 tp10 -60.34 -50.31 86.42 Favored Pre-proline 0 C--N 1.327 -0.378 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.667 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.676 ' HB3' HD11 ' A' ' 31' ' ' LEU . 52.3 Cg_exo -53.67 -23.54 26.46 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.262 1.975 . . . . 0.0 112.88 -179.271 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.546 HD22 ' HA ' ' A' ' 73' ' ' ALA . 57.2 mt -84.99 -40.69 16.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.09 -179.58 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.607 ' HA ' HD12 ' A' ' 62' ' ' LEU . 49.9 mm -58.88 -43.33 88.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.837 -179.536 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -70.03 -26.65 64.14 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -178.821 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.689 HD21 ' HA2' ' A' ' 40' ' ' GLY . 5.2 tp -88.97 -29.07 19.81 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -178.21 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.639 HD13 HD22 ' A' ' 92' ' ' LEU . 15.5 mt -58.66 -19.16 36.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.975 0.417 . . . . 0.0 110.565 179.153 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -111.93 -0.93 15.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.162 -179.882 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.541 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 6.2 t70 -61.25 -36.95 81.38 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.408 0.623 . . . . 0.0 110.482 -179.849 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.459 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 10.8 m-20 56.7 25.67 10.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.522 179.296 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.456 ' HB2' ' OD1' ' A' ' 64' ' ' ASP . 0.3 OUTLIER -80.5 -27.75 37.66 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 121.057 0.456 . . . . 0.0 109.959 179.262 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 131.9 -103.64 0.54 Allowed Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.554 179.709 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.512 ' HE2' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -58.34 -24.31 59.37 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 117.041 0.42 . . . . 0.0 109.949 179.855 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.408 HG12 ' HA3' ' A' ' 40' ' ' GLY . 4.0 m -70.24 -40.19 77.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 121.231 0.539 . . . . 0.0 109.774 178.495 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.459 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 50.5 ttp180 -71.12 -44.96 64.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.542 179.921 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.4 p -67.16 -35.08 78.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.87 179.469 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.492 ' O ' ' HG2' ' A' ' 75' ' ' ARG . . . -62.22 -55.8 25.74 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.647 -179.736 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.546 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -58.08 -39.5 78.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.899 0.381 . . . . 0.0 110.714 179.749 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.458 ' HA ' HD21 ' A' ' 62' ' ' LEU . . . -61.89 -46.07 90.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.512 -179.76 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 0.2 OUTLIER -70.85 -32.64 69.73 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.423 -179.041 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' A' ' 79' ' ' GLN . 46.5 m -61.79 -34.44 75.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.806 0.336 . . . . 0.0 110.996 -179.791 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.6 HD11 HD11 ' A' ' 62' ' ' LEU . 66.5 mt -59.64 -60.65 3.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.977 0.418 . . . . 0.0 110.62 179.576 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -65.34 -18.18 65.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.641 179.456 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.437 ' HB3' ' O ' ' A' ' 76' ' ' SER . 8.7 tt0 -56.88 -39.93 75.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.91 -179.897 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.506 HG21 ' HD2' ' A' ' 84' ' ' ARG . 3.2 mp -80.43 -56.77 5.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.928 179.584 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.454 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . 71.03 58.56 5.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.339 -179.781 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -135.13 179.84 17.27 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.304 179.786 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.08 -22.1 64.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.809 0.338 . . . . 0.0 110.836 179.957 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.513 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -76.9 -31.42 56.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.786 -179.271 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.513 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 38.2 t -70.31 -33.76 55.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.915 0.388 . . . . 0.0 110.195 179.412 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.8 ttp180 -56.26 -21.93 26.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.062 179.961 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.33 -33.86 37.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.688 179.928 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.18 -31.03 68.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.971 179.805 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.509 ' HG3' ' HD2' ' A' ' 107' ' ' TYR . 10.0 mmm -72.21 -50.03 30.67 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.306 179.866 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.43 -35.62 65.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.168 179.4 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.463 ' HD3' ' O ' ' A' ' 91' ' ' LYS . 11.7 tmtt? -70.27 -31.73 69.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.866 179.853 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.639 HD22 HD13 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -85.99 -28.62 24.09 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 179.845 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.46 -28.91 60.94 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.849 178.83 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -80.18 -27.76 38.86 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.077 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.3 p -109.35 25.96 11.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.68 178.827 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.488 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -49.75 113.06 1.64 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.45 -178.983 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 58.2 m -141.1 130.4 23.63 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.181 -0.304 . . . . 0.0 110.181 179.435 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.26 -130.27 12.23 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.063 -179.381 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -95.82 -15.82 22.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.732 0.301 . . . . 0.0 110.839 179.939 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.464 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.71 -42.89 62.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.437 -179.749 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.488 ' HD2' ' HA3' ' A' ' 96' ' ' GLY . 60.5 ttt180 -59.29 -60.7 3.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.01 -179.969 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.6 tttp -49.91 -24.33 2.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.25 0.548 . . . . 0.0 110.333 179.621 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.46 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 24.1 t -79.82 -48.56 20.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.388 179.943 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.588 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -58.62 -53.08 62.35 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.258 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 28.3 t -64.91 -58.99 4.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.917 -178.084 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -55.59 -38.61 69.63 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.519 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.509 ' HD2' ' HG3' ' A' ' 89' ' ' MET . 36.7 t80 -63.34 -25.22 68.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.829 0.347 . . . . 0.0 111.231 -178.805 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 104' ' ' ALA . 94.0 mt -56.37 -20.13 17.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.543 -179.785 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -78.56 6.23 9.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.603 -179.416 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.0 p -138.9 -53.46 0.58 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.469 179.917 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.8 p-80 . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.43 -179.788 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptt? . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.802 0.334 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.35 134.83 41.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.94 179.944 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.6 t70 62.95 12.97 6.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.896 -179.888 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -128.07 -15.45 4.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.918 179.753 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -70.61 111.21 5.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.819 179.907 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -171.64 -49.59 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.01 -179.916 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -86.86 32.84 0.66 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.986 -179.943 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 53.1 t -58.86 -46.61 91.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.658 -179.694 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.482 ' HA ' HG23 ' A' ' 12' ' ' VAL . 14.9 ptm180 -128.3 2.26 5.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.604 0.24 . . . . 0.0 111.487 -179.662 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.463 ' HA ' ' NE ' ' A' ' 10' ' ' ARG . 5.2 mmp_? -64.37 105.6 0.96 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.274 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.448 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 16.0 t70 77.97 -34.29 0.18 Allowed 'General case' 0 N--CA 1.465 0.291 0 O-C-N 123.694 0.621 . . . . 0.0 110.924 -179.514 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.482 HG23 ' HA ' ' A' ' 9' ' ' ARG . 1.5 m -85.78 96.68 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-O 120.975 0.417 . . . . 0.0 110.839 179.58 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 49.7 m -82.98 -167.94 1.87 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.477 -179.361 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.549 HG22 ' H ' ' A' ' 15' ' ' ALA . 2.6 m 63.32 169.23 0.15 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.839 -179.834 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.549 ' H ' HG22 ' A' ' 14' ' ' THR . . . -95.51 -68.47 0.8 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.838 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mt -86.25 -22.78 26.67 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -178.48 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.535 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 28.3 t -56.18 -48.41 76.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.525 0.202 . . . . 0.0 111.352 -179.28 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.515 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 3.2 tpm_? -164.95 97.56 0.74 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.828 0.347 . . . . 0.0 111.299 -179.907 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.553 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 4.4 mmt -133.3 -20.81 2.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.834 179.575 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 91.74 -116.28 4.95 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.39 -179.898 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -83.35 -17.89 40.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.731 0.301 . . . . 0.0 110.987 -179.984 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 19' ' ' MET . 9.6 tp10 -71.3 -30.13 65.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.857 179.817 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.654 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -100.77 3.32 42.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.115 -179.863 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.513 ' CZ ' ' HB3' ' A' ' 53' ' ' ARG . 1.9 t80 -56.49 -64.82 0.74 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.725 179.798 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.522 ' HG3' ' HD3' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -63.36 -50.8 72.4 Favored Pre-proline 0 C--N 1.329 -0.314 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 179.563 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.654 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 53.9 Cg_exo -45.81 -25.06 2.36 Favored 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 121.933 1.756 . . . . 0.0 110.826 179.706 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.689 HD21 HG13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -82.62 -47.08 12.49 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.364 178.921 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 28' ' ' LEU . 1.0 OUTLIER -58.26 -39.33 78.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.13 178.443 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -59.81 -29.07 67.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.393 -179.21 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.9 m -64.98 -22.43 67.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.581 -179.356 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.466 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 68.0 mt -69.55 -11.74 61.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.054 -179.844 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.3 t -109.65 13.09 23.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.705 179.889 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -78.55 135.68 37.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.031 -179.862 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -58.22 -26.84 63.34 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.207 -179.986 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -84.84 130.85 34.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.046 179.993 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -84.04 -27.74 28.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.729 179.809 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.8 mtp180 -62.51 -42.11 99.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.585 179.537 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.4 mt -79.89 -31.57 13.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.768 179.952 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.466 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 35.6 ttm180 -65.53 -36.21 83.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.626 179.732 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -57.34 -48.81 77.67 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.072 179.818 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.31 -35.86 68.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.7 0.285 . . . . 0.0 110.944 179.611 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.417 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -55.7 -53.2 59.5 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.424 179.514 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.37 90.8 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.454 179.126 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.677 ' HA ' ' NH1' ' A' ' 75' ' ' ARG . 7.9 m95 -63.62 -28.55 70.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.013 -179.233 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.7 mm -98.95 -24.07 4.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.921 0.391 . . . . 0.0 111.108 179.839 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.689 HG13 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -60.84 -30.97 48.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.847 -179.315 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.514 ' HA3' HH21 ' A' ' 75' ' ' ARG . . . -61.26 -28.99 70.12 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.86 -179.744 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -59.84 -26.2 65.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.85 0.357 . . . . 0.0 110.399 179.857 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.404 ' C ' ' H ' ' A' ' 51' ' ' ASP . 47.0 m-85 -94.94 111.72 23.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.486 179.847 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -80.27 36.72 0.37 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.461 179.831 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.473 ' O ' HG23 ' A' ' 55' ' ' VAL . 20.6 m-20 -102.34 158.18 16.38 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.789 -179.698 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.72 -33.75 75.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.798 -179.189 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.513 ' HB3' ' CZ ' ' A' ' 24' ' ' PHE . 18.8 ttm180 -65.84 -13.44 59.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.951 0.405 . . . . 0.0 110.558 -180.0 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.427 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -105.15 -3.03 23.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.353 179.97 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 51' ' ' ASP . 93.2 t -91.21 -34.26 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.277 -179.907 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.465 ' N ' ' CD ' ' A' ' 57' ' ' PRO . 20.9 tt0 -60.36 -44.85 97.06 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 116.272 -0.422 . . . . 0.0 112.077 -179.864 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.554 ' O ' HD13 ' A' ' 61' ' ' LEU . 94.6 Cg_exo -45.53 -53.0 6.0 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.437 2.091 . . . . 0.0 113.578 -179.548 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.756 HD12 ' HA ' ' A' ' 73' ' ' ALA . 0.1 OUTLIER -54.27 -30.32 50.2 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.965 0.358 . . . . 0.0 111.965 -178.864 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 43.5 mm -55.12 -59.06 2.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.736 0.303 . . . . 0.0 111.584 -179.557 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -70.06 -37.16 75.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.802 -179.518 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.714 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.5 OUTLIER -52.54 -55.55 21.38 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.91 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.666 HD13 HD22 ' A' ' 92' ' ' LEU . 9.3 mt -51.76 -13.92 0.31 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.609 -179.729 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -113.11 -19.15 11.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.024 179.857 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.443 ' OD1' ' HB2' ' A' ' 66' ' ' SER . 7.9 t0 -61.18 -34.56 75.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.005 0.431 . . . . 0.0 111.422 -179.773 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.658 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 14.4 m-20 54.85 29.64 12.36 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.317 -179.707 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.507 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 40.0 t -83.18 0.29 46.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.383 -179.973 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.61 -78.19 1.67 Allowed Glycine 0 C--O 1.228 -0.237 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.199 -179.665 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.95 -45.2 94.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.158 0.504 . . . . 0.0 109.818 179.32 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.714 HG12 ' HG ' ' A' ' 61' ' ' LEU . 10.7 t -73.63 -46.68 47.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.514 -179.839 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.658 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 14.0 ttp180 -63.35 -59.23 4.97 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -179.357 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.4 t -50.91 -32.78 21.74 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.98 -179.353 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.56 ' O ' ' HG3' ' A' ' 75' ' ' ARG . . . -54.24 -47.66 67.11 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.817 179.479 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.756 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -51.04 -32.39 21.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.656 0.265 . . . . 0.0 111.558 179.9 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.94 -60.98 2.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.686 -179.226 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.73 HH21 HE22 ' A' ' 79' ' ' GLN . 0.2 OUTLIER -61.42 -27.92 68.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.711 -179.397 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 39.3 t -62.15 -52.67 62.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.726 0.298 . . . . 0.0 111.51 -179.663 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.514 ' HA ' HG11 ' A' ' 85' ' ' VAL . 8.3 mp -55.72 -60.72 3.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.645 -179.83 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -55.57 -24.65 33.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.968 0.413 . . . . 0.0 110.566 179.644 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.73 HE22 HH21 ' A' ' 75' ' ' ARG . 2.0 mt-30 -70.87 -48.25 54.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.132 179.806 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 79.5 mt -71.97 -60.71 2.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.4 -179.494 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.446 ' N ' HG21 ' A' ' 85' ' ' VAL . . . 67.75 121.33 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.729 -179.943 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.513 ' HA3' HH11 ' A' ' 84' ' ' ARG . . . 146.11 179.72 22.51 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.762 179.935 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -66.06 -31.72 72.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.919 0.39 . . . . 0.0 110.603 -179.97 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.557 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.59 -52.31 64.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.069 -179.744 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.557 ' N ' ' HG2' ' A' ' 84' ' ' ARG . 0.1 OUTLIER -70.37 -22.88 24.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.981 0.419 . . . . 0.0 110.518 179.693 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -58.63 -22.15 55.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.382 179.503 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 90' ' ' GLU . . . -76.69 -32.26 57.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.317 179.602 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.23 -48.8 77.91 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.982 179.156 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.589 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -72.12 -24.43 61.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.556 179.115 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.496 ' N ' ' HE2' ' A' ' 89' ' ' MET . 19.8 mm-40 -66.74 -35.05 79.19 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.999 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -81.49 -28.84 33.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.815 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.767 HD23 ' HB2' ' A' ' 104' ' ' ALA . 0.5 OUTLIER -85.67 -35.03 21.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.605 0.24 . . . . 0.0 110.864 -179.288 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -55.55 -28.47 55.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.963 0.411 . . . . 0.0 110.496 179.104 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -80.22 -26.17 39.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.386 179.934 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 50.0 p -117.6 30.96 6.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.615 179.2 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.421 ' HA3' ' HD2' ' A' ' 101' ' ' ARG . . . -53.35 121.55 17.45 Favored Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 115.186 -0.915 . . . . 0.0 113.539 -178.999 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.429 ' N ' ' HB2' ' A' ' 101' ' ' ARG . 29.4 m -154.13 130.27 10.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.833 0.349 . . . . 0.0 110.682 179.124 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 60.04 -158.45 25.35 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.904 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -55.35 -33.18 63.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.608 0.242 . . . . 0.0 111.247 179.972 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.716 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -48.55 -48.05 38.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.316 -179.913 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.429 ' HB2' ' N ' ' A' ' 97' ' ' THR . 72.0 ttt180 -60.23 -58.35 8.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.994 -179.618 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.541 ' HD2' HD21 ' A' ' 106' ' ' ASN . 4.6 tppp? -45.89 -24.91 0.45 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.381 -179.08 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' A' ' 100' ' ' ALA . 40.3 t -68.37 -52.98 31.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.367 179.763 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.767 ' HB2' HD23 ' A' ' 92' ' ' LEU . . . -53.41 -63.03 1.28 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.499 0.666 . . . . 0.0 112.375 -179.374 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.472 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 32.8 t -52.18 -62.83 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.779 -1.1 . . . . 0.0 113.412 -178.355 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.541 HD21 ' HD2' ' A' ' 102' ' ' LYS . 98.4 m-20 -55.45 -34.22 64.29 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -178.236 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -59.42 -28.53 67.02 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-O 120.987 0.422 . . . . 0.0 111.145 -179.031 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 15.2 mt -62.13 -14.99 42.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.61 179.949 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -79.36 5.81 11.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.863 -179.411 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 35.5 p -146.63 -34.19 0.29 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.734 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.413 ' OXT' ' HA2' ' A' ' 81' ' ' GLY . 40.8 m80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.293 -179.125 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.9 mtp . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.667 0.27 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.67 -65.13 0.57 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.309 179.982 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -116.93 -16.82 10.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 0.0 110.696 179.689 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -86.46 118.68 26.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.891 179.959 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 m120 63.71 162.67 0.11 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.22 179.9 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -168.1 -28.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.919 -179.968 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -128.98 82.65 2.1 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.043 0.449 . . . . 0.0 110.789 179.667 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.62 ' HA ' ' HG3' ' A' ' 22' ' ' GLU . 82.0 t -141.88 -71.72 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.718 179.921 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.558 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 14.0 ptm180 -99.93 -15.01 18.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.787 -179.899 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 9.8 mpt_? -67.19 114.38 5.88 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 178.256 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.4 t70 73.81 12.02 4.47 Favored 'General case' 0 C--O 1.232 0.141 0 O-C-N 123.436 0.46 . . . . 0.0 110.982 -179.596 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.558 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 9.8 p -56.78 169.13 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.887 179.911 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.545 ' H ' HG22 ' A' ' 12' ' ' VAL . 26.7 t 68.15 8.88 6.84 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 120.914 0.388 . . . . 0.0 110.916 179.751 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 29.6 m -146.82 -23.12 0.41 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.407 179.678 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.93 -2.89 22.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.353 179.981 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.417 ' H ' ' HG ' ' A' ' 16' ' ' LEU . 2.8 pp -66.43 -14.07 61.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.794 0.33 . . . . 0.0 110.975 179.946 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.7 t -79.32 -4.67 51.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.571 179.601 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -148.94 -64.64 0.23 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.546 -179.963 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 24.5 ttm -52.92 -43.66 66.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.022 179.948 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 40.85 39.9 2.07 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.311 -0.471 . . . . 0.0 113.492 179.473 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -141.66 -72.29 0.33 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.857 0.361 . . . . 0.0 110.694 179.903 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.62 ' HG3' ' HA ' ' A' ' 8' ' ' VAL . 11.6 mm-40 -67.86 -16.36 64.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.06 179.562 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.88 9.97 32.61 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.757 179.188 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.513 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 15.0 t80 -63.3 -37.15 86.15 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.151 0.501 . . . . 0.0 110.425 179.86 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.412 ' N ' ' HD2' ' A' ' 26' ' ' PRO . 1.1 mp0 -63.28 -57.68 19.36 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.998 179.759 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 25' ' ' GLU . 11.5 Cg_endo -56.08 -14.5 11.7 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 121.484 1.456 . . . . 0.0 110.13 179.235 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.426 ' HB3' ' O ' ' A' ' 24' ' ' PHE . 0.7 OUTLIER -86.86 -37.45 17.7 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.285 -1.325 . . . . 0.0 109.089 178.451 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 28' ' ' LEU . 3.4 tm? -75.96 -31.41 59.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.824 179.459 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -71.31 -15.47 62.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.416 179.917 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.417 ' HB3' HG22 ' A' ' 38' ' ' ILE . 65.2 m -66.45 -51.5 56.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.14 -179.125 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.504 HD21 HD22 ' A' ' 28' ' ' LEU . 2.4 pp -60.45 -7.71 2.26 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.7 0.286 . . . . 0.0 111.527 -179.329 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.9 m -88.93 19.71 3.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.85 0.357 . . . . 0.0 110.449 179.529 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -105.08 150.57 24.89 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.094 179.951 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -67.38 -12.37 60.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.678 179.526 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -76.0 153.57 36.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.651 -179.929 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.3 m95 -102.78 -32.81 9.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.082 -179.7 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.527 ' HG3' HG13 ' A' ' 38' ' ' ILE . 34.0 ptt180 -62.0 -39.49 92.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.938 179.981 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.527 HG13 ' HG3' ' A' ' 37' ' ' ARG . 40.9 mt -82.22 -32.32 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.999 0.428 . . . . 0.0 110.517 179.475 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -38.83 78.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.302 -179.988 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.53 -53.97 7.07 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.879 -179.462 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -50.41 -39.14 46.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.709 0.29 . . . . 0.0 111.76 -179.912 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.407 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -64.4 -33.45 75.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.24 -179.759 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.441 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -85.44 -28.88 24.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.383 -179.88 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 4.0 m95 -69.53 -31.54 69.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.267 -178.778 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.608 ' HA ' HD22 ' A' ' 48' ' ' ASN . 22.8 mt -99.29 -19.43 5.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.981 0.42 . . . . 0.0 111.199 -179.246 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.554 HG12 ' HA ' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -51.17 -27.53 6.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.826 -179.346 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -93.11 -22.67 26.9 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.111 -179.084 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.608 HD22 ' HA ' ' A' ' 45' ' ' ILE . 37.7 m-80 -69.84 -12.07 61.34 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 -179.589 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.419 ' HB2' ' HE2' ' A' ' 24' ' ' PHE . 22.2 m-85 -101.94 -35.66 8.91 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -179.747 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.436 ' HG2' HG23 ' A' ' 80' ' ' ILE . 1.4 tt0 69.61 72.06 0.24 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 0.0 110.843 179.622 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -126.68 170.53 12.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.277 179.876 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.553 ' O ' HG22 ' A' ' 55' ' ' VAL . 0.5 OUTLIER -66.43 -38.84 88.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.623 -179.292 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.458 ' HB2' ' HE1' ' A' ' 24' ' ' PHE . 0.2 OUTLIER -69.2 -9.98 55.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -179.614 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.554 ' HA ' HG12 ' A' ' 46' ' ' ILE . . . -88.59 10.61 19.88 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.902 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.553 HG22 ' O ' ' A' ' 52' ' ' GLU . 27.4 m -92.47 -49.21 13.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.851 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.525 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -60.42 -51.95 76.41 Favored Pre-proline 0 CA--C 1.533 0.297 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.963 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.525 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 71.8 Cg_exo -41.56 -53.06 3.43 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 122.404 2.069 . . . . 0.0 112.536 -179.898 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.445 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 8.4 mt -52.1 -47.87 65.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.693 -179.399 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 51.2 mt -54.76 -56.91 8.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.208 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.442 ' NZ ' ' HB2' ' A' ' 60' ' ' LYS . 0.1 OUTLIER -69.68 -16.2 63.31 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -178.876 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.885 ' HG ' HG12 ' A' ' 69' ' ' VAL . 0.6 OUTLIER -88.85 -46.26 9.08 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.303 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.845 HD13 HD11 ' A' ' 92' ' ' LEU . 7.1 mt -59.61 -15.06 16.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.176 0.512 . . . . 0.0 110.208 -179.306 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -112.31 -11.71 13.67 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.281 179.322 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.551 ' HB2' ' HA ' ' A' ' 61' ' ' LEU . 7.1 t70 -61.32 -32.12 71.98 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.772 -179.758 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.653 ' HA ' ' HD2' ' A' ' 70' ' ' ARG . 1.3 m-20 57.09 27.18 12.99 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.583 -179.82 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.522 ' HB3' ' HB ' ' A' ' 69' ' ' VAL . 35.5 t -85.55 -3.35 58.84 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.161 -179.941 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.83 -73.34 2.57 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.503 179.914 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -70.32 -43.53 70.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.022 0.439 . . . . 0.0 110.029 179.536 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.885 HG12 ' HG ' ' A' ' 61' ' ' LEU . 4.7 t -73.83 -33.49 37.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.386 179.949 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.701 HH21 ' H ' ' A' ' 100' ' ' ALA . 62.5 ttt180 -77.49 -53.58 7.45 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.128 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.484 ' O ' ' HG3' ' A' ' 75' ' ' ARG . 90.8 p -50.8 -55.45 16.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.572 -178.949 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -45.35 -32.3 3.71 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 121.202 -0.523 . . . . 0.0 113.071 -179.553 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.445 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -69.47 -48.83 59.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.646 0.26 . . . . 0.0 111.179 179.94 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.65 -35.77 66.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.283 -179.616 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 71' ' ' SER . 8.8 mtp85 -74.27 -34.04 63.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.319 179.874 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.76 ' HA ' HE21 ' A' ' 79' ' ' GLN . 31.0 t -61.44 -37.02 82.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.709 -179.318 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.679 HD11 HD11 ' A' ' 62' ' ' LEU . 0.6 OUTLIER -59.95 -60.2 4.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.648 0.261 . . . . 0.0 111.072 179.944 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.405 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 10.8 pt-20 -59.44 -29.36 67.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.262 179.486 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.76 HE21 ' HA ' ' A' ' 76' ' ' SER . 21.4 mt-30 -70.67 -36.86 73.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.758 0.313 . . . . 0.0 110.761 179.647 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.436 HG23 ' HG2' ' A' ' 50' ' ' GLN . 94.2 mt -80.3 -61.51 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.528 -179.692 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 65.44 122.47 0.01 OUTLIER Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.959 -0.639 . . . . 0.0 112.664 -179.846 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.436 ' O ' HG23 ' A' ' 85' ' ' VAL . . . 145.91 171.02 15.05 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.624 -179.992 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.63 -26.97 68.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.643 0.258 . . . . 0.0 111.384 -179.752 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.508 ' HG2' ' N ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -62.22 -49.26 76.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.028 0.442 . . . . 0.0 110.288 179.785 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.581 HG11 ' HA ' ' A' ' 77' ' ' LEU . 0.1 OUTLIER -70.85 -23.73 24.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.16 179.947 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 82' ' ' GLY . 98.5 mtt180 -58.64 -27.76 65.03 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.871 0.367 . . . . 0.0 110.558 179.533 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 91' ' ' LYS . . . -72.34 -29.09 63.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.145 179.585 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.36 -45.39 63.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.843 179.738 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.511 ' HB2' ' HB1' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -70.29 -33.08 71.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.886 0.374 . . . . 0.0 110.26 179.562 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.96 -34.67 76.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.921 178.915 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 29.8 mmmt -61.0 -40.77 94.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.978 179.223 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.845 HD11 HD13 ' A' ' 62' ' ' LEU . 66.1 mt -71.21 -38.54 72.03 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.988 179.836 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.458 ' HA ' ' NE ' ' A' ' 101' ' ' ARG . . . -52.76 -27.7 19.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.441 179.84 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -97.49 -10.49 25.25 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 -179.404 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.473 ' OG1' ' HA ' ' A' ' 92' ' ' LEU . 47.4 p -106.16 -31.42 8.69 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.72 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.556 ' HA2' ' HD3' ' A' ' 101' ' ' ARG . . . 52.67 92.9 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.877 -179.866 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.441 ' H ' ' HB2' ' A' ' 101' ' ' ARG . 79.7 m -140.24 129.23 23.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.39 . . . . 0.0 111.575 179.934 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.439 ' HA3' HH22 ' A' ' 70' ' ' ARG . . . 38.72 -127.88 1.88 Allowed Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.548 -0.751 . . . . 0.0 113.767 179.498 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.437 ' H ' ' HD1' ' A' ' 99' ' ' PHE . 0.4 OUTLIER -92.81 -21.88 19.64 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.479 0.18 . . . . 0.0 110.982 -179.703 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.701 ' H ' HH21 ' A' ' 70' ' ' ARG . . . -49.93 -40.03 42.21 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.009 0.433 . . . . 0.0 110.654 179.815 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.556 ' HD3' ' HA2' ' A' ' 96' ' ' GLY . 30.7 tpt85 -57.27 -61.56 2.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.639 179.508 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -55.66 -39.55 71.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.155 179.392 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 99' ' ' PHE . 35.3 t -60.88 -36.69 73.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.112 179.901 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.557 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -63.42 -60.95 2.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.858 -179.169 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.555 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 58.6 t -60.89 -40.49 85.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.844 -179.205 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -71.1 -28.66 64.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.823 179.743 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.405 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 4.5 t80 -63.51 -50.31 70.11 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -177.8 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 3.2 pp -52.33 -13.32 0.33 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.496 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -78.05 5.91 8.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.962 0.41 . . . . 0.0 110.715 179.335 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.5 m -124.47 -59.6 1.45 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.08 179.94 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 53.1 p-80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.442 179.807 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 pmm? . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.836 0.35 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.91 -178.97 6.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.028 -179.961 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -92.09 -33.24 14.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.093 179.986 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -92.49 -20.33 21.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.812 179.767 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -119.86 131.08 55.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.137 179.992 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -127.99 1.11 5.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.473 -179.963 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -141.86 -144.8 0.16 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.457 179.885 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 35.7 t 70.19 -83.14 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.722 179.57 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.536 ' HE ' ' HA ' ' A' ' 13' ' ' SER . 13.9 ptm180 -121.54 27.37 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.743 0.306 . . . . 0.0 111.483 -179.466 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 78.1 ttt180 -59.09 104.41 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.932 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.436 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 13.6 m-20 67.92 -0.85 1.89 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 -179.468 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.523 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 97.9 t -91.82 -37.92 9.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.971 -179.932 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.536 ' HA ' ' HE ' ' A' ' 9' ' ' ARG . 40.0 t 56.65 -88.48 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.608 179.873 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.7 p -81.79 91.99 6.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.935 0.398 . . . . 0.0 111.154 -179.917 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.438 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . . . -95.26 -1.98 50.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.518 -179.642 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.502 ' C ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -79.28 -13.72 59.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.772 -179.707 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 75.1 m -54.2 -50.78 66.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.321 -179.862 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -174.96 31.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.046 0.451 . . . . 0.0 110.867 -179.689 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 17.2 mmm -103.85 -42.3 5.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.91 -179.709 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.93 172.52 6.6 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.347 -179.803 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 65.56 -73.99 0.06 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.741 0.305 . . . . 0.0 111.373 -179.987 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.6 -43.37 65.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.009 -179.775 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.475 ' HA ' ' HG2' ' A' ' 26' ' ' PRO . . . -105.56 20.49 18.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.777 -179.535 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.522 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -63.2 -49.68 73.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.026 0.441 . . . . 0.0 110.649 179.933 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -63.32 -53.43 53.17 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.116 179.838 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.475 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 83.7 Cg_exo -41.73 -24.57 0.27 Allowed 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 122.327 2.018 . . . . 0.0 111.961 179.554 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.522 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 70.2 mt -75.91 -57.02 4.12 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.473 178.997 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.657 HD12 HD12 ' A' ' 31' ' ' LEU . 28.5 tp -62.86 -24.56 67.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.101 179.938 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.2 -45.93 37.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 -179.598 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.2 p -63.29 -15.02 55.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.348 -179.8 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.657 HD12 HD12 ' A' ' 28' ' ' LEU . 57.0 mt -63.7 -10.96 22.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.84 0.352 . . . . 0.0 111.03 179.982 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.7 t -95.82 23.33 6.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.679 179.864 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.594 HD21 ' HB2' ' A' ' 39' ' ' ARG . 1.3 p30 -88.7 148.06 24.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.95 -179.614 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -65.6 -29.25 69.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.534 -179.386 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -77.88 163.63 25.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 0.0 111.066 -179.782 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -105.04 -24.94 12.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.594 -179.879 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 56.0 mtm180 -60.9 -39.13 88.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.193 179.736 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.7 mt -79.0 -45.57 24.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.453 -179.508 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.594 ' HB2' HD21 ' A' ' 33' ' ' ASN . 32.0 ttm180 -59.51 -41.3 89.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.23 -179.52 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.684 ' HA2' HD21 ' A' ' 61' ' ' LEU . . . -65.09 -62.84 4.59 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.001 -179.534 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -49.92 -24.74 2.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.745 0.307 . . . . 0.0 111.187 179.984 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.423 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -63.07 -55.01 29.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.758 179.465 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.403 ' HA ' ' CG2' ' A' ' 46' ' ' ILE . . . -68.02 -22.51 64.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.957 0.408 . . . . 0.0 110.716 179.71 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.404 ' CD1' ' HA3' ' A' ' 72' ' ' GLY . 4.3 m95 -56.91 -47.11 81.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.588 -179.967 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.47 ' N ' HD12 ' A' ' 45' ' ' ILE . 4.4 mp -99.5 -20.69 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.0 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.656 HG23 ' HB1' ' A' ' 54' ' ' ALA . 4.1 tt -55.43 -39.21 52.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -178.269 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.509 ' HA3' ' HB3' ' A' ' 76' ' ' SER . . . -75.45 -11.44 84.29 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.512 -179.079 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -70.69 -10.98 60.63 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.149 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -95.59 -4.19 45.01 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.403 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.567 ' HG3' HG23 ' A' ' 80' ' ' ILE . 0.9 OUTLIER 46.41 56.27 6.54 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 179.494 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -127.3 151.29 48.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.893 0.377 . . . . 0.0 110.886 179.723 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.466 ' O ' HG12 ' A' ' 55' ' ' VAL . 9.4 pt-20 -59.8 -22.9 62.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.833 179.717 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.45 ' HB3' ' CE1' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -65.82 -30.64 71.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.643 179.685 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.656 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -102.18 30.54 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.471 -178.967 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.556 HG13 ' N ' ' A' ' 56' ' ' GLU . 9.9 p -91.39 -54.33 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.62 -179.964 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.556 ' N ' HG13 ' A' ' 55' ' ' VAL . 10.5 tt0 -61.0 -49.7 87.89 Favored Pre-proline 0 CA--C 1.536 0.406 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.797 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.5 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 81.5 Cg_exo -43.53 -36.73 7.26 Favored 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.5 2.133 . . . . 0.0 113.023 -179.313 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.656 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 27.5 mt -71.24 -47.14 59.0 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.07 -179.658 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.43 ' HA ' HD21 ' A' ' 62' ' ' LEU . 25.3 mt -59.4 -49.38 83.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.969 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.08 -26.81 64.17 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -177.759 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.684 HD21 ' HA2' ' A' ' 40' ' ' GLY . 21.8 tp -90.08 -30.62 17.58 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -178.236 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.612 HD11 HD22 ' A' ' 92' ' ' LEU . 4.0 pp -68.49 -8.9 45.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.121 0.486 . . . . 0.0 110.703 -179.124 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -112.32 0.27 15.64 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.018 179.298 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -61.92 -31.76 72.1 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.793 -179.668 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.553 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 14.6 t70 59.77 24.8 13.76 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.684 179.576 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.38 -20.61 43.65 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.028 0.442 . . . . 0.0 110.076 179.392 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 128.45 -110.03 1.08 Allowed Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.726 179.49 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -56.86 -23.97 48.19 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.846 0.355 . . . . 0.0 110.084 -179.949 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.589 ' HB ' HD11 ' A' ' 61' ' ' LEU . 3.7 m -69.15 -37.33 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-O 121.35 0.595 . . . . 0.0 110.013 179.298 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.553 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 3.8 ttm180 -63.0 -53.52 52.71 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.529 179.776 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 72.1 m -67.17 -38.7 85.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.424 179.935 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.404 ' HA3' ' CD1' ' A' ' 44' ' ' TRP . . . -52.53 -61.76 6.42 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.617 -179.668 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.656 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -59.06 -34.76 72.33 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.684 0.278 . . . . 0.0 111.073 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.412 ' HB1' HG21 ' A' ' 103' ' ' VAL . . . -61.2 -58.04 9.96 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.964 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' A' ' 79' ' ' GLN . 10.2 ptp180 -55.09 -34.39 63.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.507 -179.02 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.634 ' HA ' HE21 ' A' ' 79' ' ' GLN . 49.9 m -57.16 -34.03 68.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.641 0.258 . . . . 0.0 111.192 179.963 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.4 mp -60.47 -61.08 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.753 0.311 . . . . 0.0 110.977 179.592 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.424 ' HG2' ' HB2' ' A' ' 107' ' ' TYR . 42.9 mt-10 -64.47 -19.23 65.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.274 0.559 . . . . 0.0 110.102 179.073 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.634 HE21 ' HA ' ' A' ' 76' ' ' SER . 8.7 tt0 -70.78 -29.45 65.66 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.705 179.929 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.567 HG23 ' HG3' ' A' ' 50' ' ' GLN . 85.3 mt -84.52 -60.18 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.103 179.961 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.5 123.43 0.04 OUTLIER Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.623 179.908 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 137.45 172.88 12.69 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.576 179.802 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.25 -22.07 27.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.006 0.431 . . . . 0.0 111.074 179.826 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.582 ' HD3' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.94 -63.09 1.37 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.302 -179.872 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.546 HG21 ' HB ' ' A' ' 80' ' ' ILE . 20.3 t -70.67 -21.11 22.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.991 179.687 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.465 ' HA ' ' SD ' ' A' ' 89' ' ' MET . 68.3 mtt180 -53.31 -24.16 11.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.769 -179.529 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.87 -36.47 28.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.409 179.197 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.52 -39.33 70.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.872 -179.987 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.502 ' SD ' ' HB3' ' A' ' 108' ' ' LEU . 19.1 ptt? -63.75 -38.8 92.45 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -179.745 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -68.05 -26.49 65.88 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.446 178.656 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? -72.36 -41.94 65.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.483 179.403 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.612 HD22 HD11 ' A' ' 62' ' ' LEU . 8.8 mt -65.37 -38.42 89.98 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.604 179.917 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -53.75 -29.65 40.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.734 179.556 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -83.19 -24.62 32.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.352 179.049 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.3 p -114.58 31.49 6.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.178 179.367 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.531 ' HA3' HH11 ' A' ' 101' ' ' ARG . . . -45.96 99.15 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.698 -0.683 . . . . 0.0 113.291 -179.355 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.7 m -146.78 130.74 17.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.738 0.304 . . . . 0.0 110.28 179.618 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.87 -144.97 33.15 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.436 -0.888 . . . . 0.0 111.685 -179.386 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.45 -16.01 22.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.782 0.325 . . . . 0.0 110.547 179.604 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.437 ' HB1' HD13 ' A' ' 62' ' ' LEU . . . -55.79 -29.47 59.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.456 179.701 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.531 HH11 ' HA3' ' A' ' 96' ' ' GLY . 16.0 tpt180 -67.36 -57.67 6.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.996 178.844 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -49.38 -34.7 16.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.955 179.004 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.412 HG21 ' HB1' ' A' ' 74' ' ' ALA . 38.5 t -61.25 -55.45 24.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.15 179.785 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.565 ' HB2' HD12 ' A' ' 92' ' ' LEU . . . -56.18 -61.64 2.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.859 -179.277 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.482 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 45.1 t -50.76 -52.91 15.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.943 -179.304 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -71.13 -19.66 62.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.305 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.443 ' OH ' ' HB ' ' A' ' 85' ' ' VAL . 3.0 t80 -64.31 -51.83 61.49 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -177.721 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.502 ' HB3' ' SD ' ' A' ' 89' ' ' MET . 1.9 pp -52.07 -14.99 0.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.076 -178.982 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -72.41 3.33 4.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.727 0.299 . . . . 0.0 110.62 179.56 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.1 p -141.51 -47.95 0.39 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.268 -179.845 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 43.7 p-80 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.518 -179.971 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.2 ttp . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 120.883 0.373 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.55 -28.95 68.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.502 -179.843 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -127.97 15.76 6.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.917 -179.655 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 63.65 153.51 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.946 -179.704 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -65.09 90.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.779 179.846 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.449 ' HB3' ' HD3' ' A' ' 10' ' ' ARG . 63.8 mttp -147.25 12.38 1.06 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.351 -179.789 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -120.12 24.43 10.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.701 0.286 . . . . 0.0 111.411 179.995 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 p -85.7 -34.87 8.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.583 -179.838 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.672 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 31.5 ttm180 -155.46 -9.86 0.12 Allowed 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.31 -179.837 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.449 ' HD3' ' HB3' ' A' ' 6' ' ' LYS . 38.0 mtp180 -61.58 109.05 1.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 177.502 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 4.5 m-20 66.85 30.49 7.82 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -177.194 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.672 ' HB ' ' HA ' ' A' ' 9' ' ' ARG . 5.0 p -42.27 150.59 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 CA-C-N 114.803 -1.09 . . . . 0.0 111.42 -179.129 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.468 ' H ' ' HG2' ' A' ' 18' ' ' ARG . 9.7 t -168.7 -73.93 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.058 -178.722 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.59 ' HB ' ' HB3' ' A' ' 17' ' ' SER . 3.1 m -66.85 168.12 10.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.61 179.763 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.511 ' H ' HG22 ' A' ' 14' ' ' THR . . . -95.29 -64.24 1.08 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.082 0.468 . . . . 0.0 111.491 -179.875 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.538 HD22 ' HG ' ' A' ' 27' ' ' LEU . 12.4 mt -71.57 -22.63 61.71 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.12 -178.595 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.59 ' HB3' ' HB ' ' A' ' 14' ' ' THR . 23.1 t -87.0 -51.12 6.2 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.298 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.468 ' HG2' ' H ' ' A' ' 13' ' ' SER . 10.2 mpt_? -78.62 -72.59 0.37 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -178.829 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -73.46 27.33 0.07 Allowed 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.004 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.447 ' H ' ' C ' ' A' ' 18' ' ' ARG . . . -53.28 -173.16 0.05 OUTLIER Glycine 0 C--N 1.334 0.433 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.476 179.158 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' A' ' 20' ' ' GLY . 21.4 t70 68.41 -72.95 0.09 Allowed 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -178.803 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -65.58 -26.32 67.8 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.827 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.479 ' C ' ' HD2' ' A' ' 26' ' ' PRO . . . -105.49 20.27 19.17 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.497 179.212 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.701 ' HZ ' ' HB2' ' A' ' 54' ' ' ALA . 4.2 t80 -63.45 -39.49 94.61 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.951 -179.962 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.428 ' HB2' ' HD3' ' A' ' 26' ' ' PRO . 39.1 mt-10 -57.27 -55.13 47.49 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.228 -179.312 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.479 ' HD2' ' C ' ' A' ' 23' ' ' ALA . 91.8 Cg_exo -37.54 -30.24 0.13 Allowed 'Trans proline' 0 C--N 1.359 1.104 0 C-N-CA 122.627 2.218 . . . . 0.0 111.997 179.079 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.575 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 22.7 mt -71.28 -58.71 3.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.828 179.212 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.569 ' HA ' HD12 ' A' ' 31' ' ' LEU . 41.9 tp -62.8 -21.45 65.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.896 179.997 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -79.55 -47.76 14.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.669 -179.905 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.8 m -66.41 -13.3 60.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.76 -179.758 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.569 HD12 ' HA ' ' A' ' 28' ' ' LEU . 46.8 mt -62.59 -10.27 11.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.658 0.266 . . . . 0.0 111.344 -179.733 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 35.9 m -89.96 6.88 40.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.893 179.933 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.763 HD21 ' HB2' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -83.4 141.01 32.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.145 0.498 . . . . 0.0 111.327 -179.827 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.88 -9.57 45.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.855 -179.745 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -78.61 147.53 33.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.815 0.34 . . . . 0.0 111.108 -179.495 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.8 p-90 -98.62 -37.31 9.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.345 -179.792 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.2 tpt180 -59.51 -43.26 93.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.167 -179.877 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.7 mt -78.07 -49.48 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.219 -179.784 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.763 ' HB2' HD21 ' A' ' 33' ' ' ASN . 42.8 ttp180 -54.87 -30.92 59.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.853 179.824 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.09 -58.92 6.25 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.52 -179.926 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -48.56 -27.73 2.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.774 0.321 . . . . 0.0 111.329 -179.942 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.437 ' O ' ' HB ' ' A' ' 46' ' ' ILE . . . -61.32 -51.96 66.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 179.797 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.554 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -73.17 -31.01 63.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.174 179.867 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.6 m95 -55.92 -37.64 69.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.441 -179.632 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.445 ' HA ' HD22 ' A' ' 48' ' ' ASN . 47.5 mt -99.56 -22.91 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.078 0.466 . . . . 0.0 110.907 -179.626 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.555 HG12 ' HA ' ' A' ' 54' ' ' ALA . 0.0 OUTLIER -51.35 -39.56 21.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.33 -178.853 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -76.86 -25.7 64.09 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.655 -0.783 . . . . 0.0 113.767 -178.868 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.445 HD22 ' HA ' ' A' ' 45' ' ' ILE . 47.5 m-80 -70.82 -2.05 13.6 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -178.769 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.457 ' HB2' ' HE2' ' A' ' 24' ' ' PHE . 22.4 m-30 -112.71 -12.47 13.37 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.437 -0.505 . . . . 0.0 112.2 -179.449 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.524 ' HG2' HG23 ' A' ' 80' ' ' ILE . 0.6 OUTLIER 53.21 68.93 0.76 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.796 0.332 . . . . 0.0 111.212 179.331 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -127.48 164.25 22.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.869 0.366 . . . . 0.0 111.026 179.963 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -63.34 -43.72 96.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.78 179.564 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -6.53 21.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.29 -179.991 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.701 ' HB2' ' HZ ' ' A' ' 24' ' ' PHE . . . -93.89 1.44 56.36 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.037 0.446 . . . . 0.0 111.041 -178.926 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.7 t -91.34 -49.13 13.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.24 -178.728 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.472 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . 43.6 tt0 -60.23 -48.79 93.27 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.105 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.472 ' HD3' ' HB3' ' A' ' 56' ' ' GLU . 93.6 Cg_exo -43.06 -42.93 9.66 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.381 2.054 . . . . 0.0 112.873 -179.878 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.48 ' HA ' ' HB1' ' A' ' 73' ' ' ALA . 4.0 mt -66.35 -36.68 83.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.265 -179.284 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 29.2 mm -59.45 -59.03 4.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.192 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -70.05 -20.79 63.22 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.355 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.667 ' HG ' ' HB ' ' A' ' 69' ' ' VAL . 5.3 mp -83.38 -46.06 12.99 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -178.385 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.479 HD13 HD22 ' A' ' 92' ' ' LEU . 52.9 mt -61.37 -10.9 8.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.091 0.472 . . . . 0.0 110.5 -179.338 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.75 -17.05 13.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.285 179.126 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -62.09 -38.84 90.4 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.936 -179.68 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.566 ' HA ' ' HD3' ' A' ' 70' ' ' ARG . 5.3 m-20 57.74 27.39 14.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.712 -179.947 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.81 -25.67 59.18 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.003 0.43 . . . . 0.0 110.326 179.557 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 120.7 -82.12 0.34 Allowed Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.408 179.861 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.74 -33.23 75.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.295 0.569 . . . . 0.0 109.613 179.179 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.667 ' HB ' ' HG ' ' A' ' 61' ' ' LEU . 3.2 m -71.91 -42.14 69.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.473 -179.767 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.566 ' HD3' ' HA ' ' A' ' 65' ' ' ASP . 25.7 ttp180 -75.48 -47.57 26.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.076 -179.172 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 46.6 t -58.81 -50.29 74.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.482 179.605 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -54.9 -51.04 56.13 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.918 179.486 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.48 ' HB1' ' HA ' ' A' ' 58' ' ' LEU . . . -56.52 -33.42 66.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.673 0.273 . . . . 0.0 110.977 179.364 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.91 -54.19 45.39 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.54 -179.546 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.41 ' H ' ' HG2' ' A' ' 75' ' ' ARG . 10.2 ptp180 -69.76 -19.5 63.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.732 -179.589 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.548 ' HA ' ' NE2' ' A' ' 79' ' ' GLN . 59.8 m -58.74 -47.59 84.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.576 -179.863 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.468 ' HA ' HG21 ' A' ' 85' ' ' VAL . 6.3 mp -56.44 -54.9 40.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.846 -179.973 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.459 ' HA ' ' HE1' ' A' ' 107' ' ' TYR . 47.0 mt-10 -49.07 -34.0 12.76 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.422 179.463 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.548 ' NE2' ' HA ' ' A' ' 76' ' ' SER . 18.9 mt-30 -69.91 -41.62 74.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.015 -179.997 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.524 HG23 ' HG2' ' A' ' 50' ' ' GLN . 88.4 mt -69.3 -61.02 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.943 179.645 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 62.49 113.83 0.01 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.119 -0.562 . . . . 0.0 112.989 179.658 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.433 ' O ' HG12 ' A' ' 85' ' ' VAL . . . 156.01 175.2 26.73 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.781 179.709 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.26 -23.34 61.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.841 0.353 . . . . 0.0 110.802 179.724 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.639 ' HD3' ' H ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.83 -45.48 61.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.046 -179.796 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.639 ' H ' ' HD3' ' A' ' 84' ' ' ARG . 8.8 p -71.05 -26.47 27.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.231 0.538 . . . . 0.0 110.647 179.761 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.429 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 6.1 ttt180 -53.76 -28.76 36.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.798 179.581 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.18 -32.12 73.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.717 179.71 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.18 -57.89 10.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.343 -179.972 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.577 ' HB2' ' HA ' ' A' ' 104' ' ' ALA . 0.0 OUTLIER -68.15 -24.61 65.0 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.822 -179.886 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.402 ' N ' ' SD ' ' A' ' 89' ' ' MET . 2.1 tm-20 -63.89 -44.19 93.77 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.119 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -72.22 -22.22 61.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.114 179.533 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.534 HD21 ' O ' ' A' ' 100' ' ' ALA . 0.3 OUTLIER -86.57 -28.54 23.25 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 120.81 0.338 . . . . 0.0 110.269 179.978 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.0 -19.15 65.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.948 179.667 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -84.56 -24.9 29.04 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.177 179.619 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 42.5 p -120.38 19.06 12.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.893 179.101 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 92' ' ' LEU . . . -49.75 121.27 9.02 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.271 -179.263 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.6 t -142.59 130.66 21.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.842 0.354 . . . . 0.0 110.987 179.556 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.85 -136.53 46.42 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.677 -179.943 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.502 ' O ' HG23 ' A' ' 103' ' ' VAL . 48.1 t80 -66.25 -34.86 78.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.786 0.327 . . . . 0.0 111.012 179.997 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.534 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -51.59 -33.84 34.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.979 -179.59 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.0 ttp180 -72.63 -55.36 6.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.512 -179.408 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -49.25 -21.64 0.86 Allowed 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.233 0.54 . . . . 0.0 110.484 179.722 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 99' ' ' PHE . 55.2 t -71.01 -58.77 4.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.609 179.81 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.577 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.88 -47.57 82.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.276 0.56 . . . . 0.0 112.368 -179.278 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.533 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 40.2 t -64.91 -51.5 65.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.342 -0.844 . . . . 0.0 112.878 -178.042 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -64.0 -45.36 89.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.671 0.272 . . . . 0.0 111.519 -179.248 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.459 ' HE1' ' HA ' ' A' ' 78' ' ' GLU . 61.1 t80 -60.44 -22.55 63.56 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.68 -179.049 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.533 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 1.0 OUTLIER -55.13 -18.11 5.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.089 179.884 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -71.47 -1.3 12.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.813 179.691 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 4.0 m -145.45 32.75 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.443 -179.981 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.1 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.961 179.84 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 mmt . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.818 0.342 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.4 ' HB1' ' HG2' ' A' ' 4' ' ' GLU . . . -106.8 -17.83 14.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.548 179.444 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 58.09 13.71 2.37 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.298 179.754 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.4 ' HG2' ' HB1' ' A' ' 2' ' ' ALA . 9.9 pt-20 -130.91 -0.04 4.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.514 179.87 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 -110.14 105.11 14.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.758 179.935 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.416 ' H ' ' H ' ' A' ' 7' ' ' TRP . 22.1 pttp -161.64 -9.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.688 -179.915 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.416 ' H ' ' H ' ' A' ' 6' ' ' LYS . 27.5 p-90 -126.5 25.88 6.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.712 -179.825 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.439 ' C ' ' H ' ' A' ' 10' ' ' ARG . 9.2 p -72.9 145.81 11.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.209 -179.915 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.5 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 38.1 ttm180 71.91 -18.92 0.29 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.627 179.661 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.484 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 29.5 mtp180 -62.96 104.09 0.52 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 178.439 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.484 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 15.9 m-20 70.65 12.19 7.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.449 -179.473 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.588 HG13 ' N ' ' A' ' 13' ' ' SER . 12.7 p -54.5 -54.04 25.67 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.606 -179.86 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.588 ' N ' HG13 ' A' ' 12' ' ' VAL . 34.9 t 51.95 -88.17 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.471 179.31 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 12' ' ' VAL . 32.3 p -70.5 172.31 8.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.583 179.453 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.69 -70.38 0.72 Allowed 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.183 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.532 ' C ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -87.88 -20.88 25.4 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.35 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.473 ' N ' HD13 ' A' ' 16' ' ' LEU . 34.0 m -71.86 -51.48 22.13 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.55 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.3 ttm180 -138.15 98.8 3.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.05 0.452 . . . . 0.0 111.682 -179.424 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.732 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -134.42 -42.96 0.77 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.784 179.519 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.429 ' N ' ' SD ' ' A' ' 19' ' ' MET . . . 95.47 -36.86 3.62 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.247 179.709 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -160.08 -16.58 0.06 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -179.348 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -67.64 -44.68 77.35 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -178.994 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.732 ' HB3' ' HG2' ' A' ' 19' ' ' MET . . . -106.33 -0.47 24.27 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.654 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.574 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -52.25 -50.17 62.59 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.975 0.417 . . . . 0.0 110.463 179.553 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.495 ' HA ' HD23 ' A' ' 28' ' ' LEU . 3.7 mt-10 -63.36 -57.87 18.31 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.802 179.636 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.61 ' HG2' ' HA ' ' A' ' 23' ' ' ALA . 74.6 Cg_exo -43.73 -30.88 3.1 Favored 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 122.077 1.851 . . . . 0.0 111.554 179.795 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.574 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 36.6 mt -62.8 -56.85 13.75 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.354 178.918 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.588 HD22 ' HB2' ' A' ' 53' ' ' ARG . 0.9 OUTLIER -69.82 -19.6 63.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.126 179.515 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -73.33 -39.57 65.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.781 179.552 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.0 m -66.42 -7.18 17.7 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.116 179.778 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.49 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 96.4 mt -61.24 -19.87 62.17 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.914 0.388 . . . . 0.0 110.479 179.626 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 83.4 p -92.51 12.05 24.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.074 179.968 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -72.55 139.15 47.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.777 -179.762 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.39 -31.78 73.03 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.855 -179.942 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -77.39 147.97 35.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.495 179.782 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 25.8 p-90 -89.44 -40.24 12.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.463 -179.473 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -60.28 -25.52 65.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.913 0.387 . . . . 0.0 110.723 179.756 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.3 mm -81.08 -47.77 19.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.087 179.974 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.49 ' HG3' ' HA ' ' A' ' 31' ' ' LEU . 49.4 ttp180 -63.73 -22.08 66.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.877 179.901 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.48 ' HA2' ' HA ' ' A' ' 69' ' ' VAL . . . -69.04 -59.16 6.09 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.606 -179.885 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' ' 44' ' ' TRP . . . -50.26 -20.37 1.04 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.704 0.288 . . . . 0.0 111.597 180.0 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.86 -55.09 37.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.354 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.592 ' HA ' ' HB ' ' A' ' 46' ' ' ILE . . . -73.81 -25.47 60.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.175 -179.959 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.403 ' HB2' ' HA ' ' A' ' 41' ' ' ALA . 6.7 m95 -55.46 -36.95 67.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.211 -179.586 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.0 mt -100.1 -26.14 3.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.039 0.447 . . . . 0.0 111.128 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.592 ' HB ' ' HA ' ' A' ' 43' ' ' ALA . 0.9 OUTLIER -56.3 -46.61 81.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.34 -178.873 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.406 ' N ' HG22 ' A' ' 46' ' ' ILE . . . -61.35 -21.61 60.08 Favored Glycine 0 CA--C 1.518 0.281 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.391 -179.058 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -70.71 -20.9 62.62 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 -179.064 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -92.08 -28.78 16.92 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.142 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.72 27.31 14.71 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 179.367 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.511 ' O ' HG23 ' A' ' 55' ' ' VAL . 12.0 t70 -96.12 170.03 9.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.767 0.317 . . . . 0.0 111.272 -179.866 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -54.12 -52.09 62.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.038 179.672 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.588 ' HB2' HD22 ' A' ' 28' ' ' LEU . 3.2 ptt180 -61.6 -8.47 4.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.225 179.66 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.543 ' HB1' HG23 ' A' ' 46' ' ' ILE . . . -104.97 -21.0 13.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.92 0.391 . . . . 0.0 111.067 -179.691 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 51' ' ' ASP . 69.5 t -73.58 -54.17 16.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.694 -179.633 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.452 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 25.5 tt0 -54.21 -47.7 96.57 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 -179.527 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.501 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 97.2 Cg_exo -42.08 -46.92 7.02 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 122.489 2.126 . . . . 0.0 112.561 179.623 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.553 HD13 HD22 ' A' ' 77' ' ' LEU . 6.1 mt -63.48 -42.34 98.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.938 -179.592 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.0 mm -51.46 -54.84 10.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.345 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp -70.06 -47.89 60.09 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.278 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.682 ' HG ' HG12 ' A' ' 69' ' ' VAL . 1.1 mp -60.17 -40.55 90.35 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.054 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.637 HD11 HD21 ' A' ' 77' ' ' LEU . 37.2 mt -56.77 -15.71 5.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.287 0.565 . . . . 0.0 109.999 -179.555 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -99.57 -30.98 11.83 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.293 178.235 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -62.21 87.77 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.174 178.957 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.465 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 16.6 m-20 -73.91 41.91 0.13 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.246 -178.798 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.9 t -85.75 -30.82 22.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.782 0.325 . . . . 0.0 111.125 179.763 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 126.46 -106.54 0.85 Allowed Glycine 0 C--O 1.228 -0.267 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.996 -179.686 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -46.7 -29.73 2.03 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.631 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.682 HG12 ' HG ' ' A' ' 61' ' ' LEU . 47.0 t -68.19 -54.98 18.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.963 179.559 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.465 ' HE ' ' HA ' ' A' ' 65' ' ' ASP . 0.2 OUTLIER -66.79 -54.69 20.07 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.257 179.736 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.3 m -50.95 -31.3 17.37 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.536 -179.614 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.46 -46.12 95.0 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.429 179.922 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.438 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . . . -70.21 -32.94 71.06 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 -179.837 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.34 -61.53 2.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.817 0.342 . . . . 0.0 111.648 -179.189 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 75' ' ' ARG . 6.4 ptp180 -60.68 -20.48 61.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.746 -179.425 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.664 ' HA ' HE21 ' A' ' 79' ' ' GLN . 50.2 m -67.15 -36.03 80.96 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.27 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.637 HD21 HD11 ' A' ' 62' ' ' LEU . 4.2 mm? -54.81 -61.05 2.56 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.724 0.297 . . . . 0.0 111.416 179.748 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.5 ' HG2' ' HD1' ' A' ' 107' ' ' TYR . 37.6 mt-10 -56.36 -41.28 75.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.889 179.567 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.664 HE21 ' HA ' ' A' ' 76' ' ' SER . 20.3 mt-30 -62.32 -40.96 98.06 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -178.772 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 72.9 mt -60.74 -59.77 3.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -179.176 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.492 ' H ' HG21 ' A' ' 85' ' ' VAL . . . 174.59 -124.92 1.05 Allowed Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.09 -1.053 . . . . 0.0 113.392 179.938 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.456 ' HA2' ' OH ' ' A' ' 107' ' ' TYR . . . -146.64 -66.67 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.411 -0.899 . . . . 0.0 113.748 -179.099 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.59 -27.08 63.83 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.335 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.565 ' HD3' ' H ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -85.05 -48.34 9.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.863 0.363 . . . . 0.0 110.517 -179.277 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.579 HG12 HD13 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -70.85 -20.77 22.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.723 178.858 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -47.28 -29.66 2.6 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.637 179.088 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.74 -36.84 50.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.75 179.963 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.91 -47.64 84.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.919 179.615 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.664 ' HE3' ' HG3' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -67.6 -30.29 69.84 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.509 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.664 ' HG3' ' HE3' ' A' ' 89' ' ' MET . 22.1 mt-10 -66.49 -33.89 76.71 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.122 179.171 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -70.72 -38.67 73.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.113 179.788 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.54 HD21 ' O ' ' A' ' 100' ' ' ALA . 0.1 OUTLIER -82.05 -23.66 35.74 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.652 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.31 -26.36 68.73 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.298 179.024 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -80.22 -26.76 38.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.708 179.887 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 58.3 p -112.54 23.02 14.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.171 178.54 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.452 ' HA3' ' HD3' ' A' ' 101' ' ' ARG . . . -56.07 116.1 6.92 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.064 -0.971 . . . . 0.0 113.508 -178.958 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.8 t -147.79 130.32 15.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.741 0.305 . . . . 0.0 110.72 179.05 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.07 -142.19 48.41 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.734 -179.833 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -62.54 -29.45 70.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 111.009 179.985 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.54 ' O ' HD21 ' A' ' 92' ' ' LEU . . . -56.24 -37.63 70.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.505 -179.747 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.452 ' HD3' ' HA3' ' A' ' 96' ' ' GLY . 18.0 ttp180 -70.91 -55.55 8.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.622 -179.594 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 57.7 tttp -47.67 -23.18 0.63 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.163 0.506 . . . . 0.0 110.948 -179.872 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.431 HG11 HD22 ' A' ' 62' ' ' LEU . 17.8 t -68.4 -60.43 2.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.73 179.903 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.5 ' HA ' ' HB2' ' A' ' 89' ' ' MET . . . -57.6 -56.28 24.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.38 -179.156 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.424 ' O ' ' HB2' ' A' ' 108' ' ' LEU . 19.4 t -56.42 -63.17 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.026 -178.245 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 102' ' ' LYS . 15.0 m120 -57.08 -27.72 61.99 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -178.674 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.5 ' HD1' ' HG2' ' A' ' 78' ' ' GLU . 4.4 t80 -59.83 -31.09 69.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.362 . . . . 0.0 110.359 179.768 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.424 ' HB2' ' O ' ' A' ' 105' ' ' VAL . 16.6 mt -52.65 -23.77 7.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.107 179.619 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -58.87 -8.75 1.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.215 179.747 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 70.5 p -93.19 -54.0 3.89 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.553 179.443 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 61.7 m80 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.322 -0.847 . . . . 0.0 110.932 179.843 . . . . . . . . 0 0 . 1 stop_ save_