data_6qan_residue ############################ # Computer software used # ############################ 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 6qan _Structure_validation_residue.Date_analyzed 2019-02-22 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 ' 1' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 120.488 0.185 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.429 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.5 t70 -129.03 -48.44 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 125.312 1.445 . . . . 0.0 113.995 178.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.429 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 72.9 Cg_endo -74.77 -30.02 8.04 Favored 'Trans proline' 0 C--N 1.356 0.935 0 CA-C-N 121.984 1.744 . . . . 0.0 112.99 174.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 43.21 43.56 4.04 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.727 2.411 . . . . 0.0 114.717 171.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.4 mt -68.82 -37.12 78.98 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -174.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -149.3 3.62 0.59 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.553 1.141 . . . . 0.0 114.054 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.507 0 O-C-N 120.958 -1.089 . . . . 0.0 113.507 -176.537 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.3 mtm180 . . . . . 0 N--CA 1.473 0.686 0 CA-C-O 120.537 0.208 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -72.04 -33.69 68.2 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -167.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -97.29 -29.86 13.3 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.301 1.041 . . . . 0.0 111.086 175.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -57.28 -41.76 93.15 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.104 0.859 . . . . 0.0 113.359 169.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.675 0 CA-C-N 118.013 0.906 . . . . 0.0 112.816 172.704 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 . . . . . 0 CA--C 1.548 0.868 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -113.48 -11.83 13.02 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 173.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -67.15 -53.82 27.04 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.369 0.986 . . . . 0.0 110.918 158.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.9 p -63.54 -18.76 64.19 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.54 -16.53 56.52 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 171.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.242 0 CA-C-O 118.255 -1.303 . . . . 0.0 115.134 178.246 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 . . . . . 0 N--CA 1.48 1.044 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.69 41.05 13.15 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.591 1.556 . . . . 0.0 112.89 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.4 tpt85 -112.92 6.68 17.96 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 127.609 2.364 . . . . 0.0 112.142 -169.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.13 22.23 59.5 Favored Glycine 0 CA--C 1.532 1.146 0 CA-C-O 118.687 -1.063 . . . . 0.0 113.761 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.288 7.1 p 40.4 77.98 0.39 Allowed Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 127.308 2.243 . . . . 0.0 113.441 -177.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -39.09 -44.54 2.62 Favored 'Trans proline' 0 C--N 1.355 0.895 1 C-N-CA 126.101 4.534 . . . . 0.0 118.417 -164.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -9.9 9.29 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 178.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.7 m -129.9 7.59 5.17 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.512 1.925 . . . . 0.0 113.044 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -71.41 140.06 84.6 Favored Pre-proline 0 CA--C 1.554 1.104 0 O-C-N 121.023 -1.048 . . . . 0.0 110.523 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -48.24 -39.29 34.63 Favored 'Trans proline' 0 CA--C 1.549 1.23 0 C-N-CA 123.492 2.795 . . . . 0.0 117.66 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -61.22 -18.63 59.68 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 123.481 2.787 . . . . 0.0 115.419 173.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -104.23 4.39 33.8 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.517 1.527 . . . . 0.0 112.532 172.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.52 46.7 8.22 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.2 2.2 . . . . 0.0 115.56 173.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.6 mt . . . . . 0 N--CA 1.479 1.004 0 C-N-CA 126.258 1.823 . . . . 0.0 114.731 -179.126 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 120.607 0.242 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -133.65 -49.05 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.169 1.388 . . . . 0.0 113.796 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -73.03 -33.86 7.05 Favored 'Trans proline' 0 C--N 1.357 0.977 0 CA-C-N 122.06 1.771 . . . . 0.0 112.918 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.48 39.53 3.26 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 127.566 2.346 . . . . 0.0 114.873 172.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.5 mt -72.32 -31.74 65.93 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -175.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -148.38 2.93 0.66 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.651 0 O-C-N 120.99 -1.069 . . . . 0.0 113.42 -177.289 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.0 mtm180 . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.3 0.095 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -72.83 -19.03 61.4 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 -167.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -117.3 -28.37 6.17 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.493 1.517 . . . . 0.0 111.339 176.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.88 -41.04 91.23 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.042 0.829 . . . . 0.0 113.22 167.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.644 0 CA-C-N 118.054 0.927 . . . . 0.0 112.811 172.039 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.1 t70 . . . . . 0 CA--C 1.547 0.848 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -113.27 -13.87 12.9 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 172.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -66.76 -53.37 33.78 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.46 1.027 . . . . 0.0 111.001 160.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.1 p -62.56 -18.65 62.5 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.02 -14.63 60.9 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 171.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.294 0 CA-C-O 118.021 -1.433 . . . . 0.0 115.975 179.792 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.31 43.98 15.61 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 125.375 1.47 . . . . 0.0 112.674 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.1 tpt85 -121.86 19.02 11.01 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.651 2.38 . . . . 0.0 111.341 -166.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.14 23.15 61.79 Favored Glycine 0 CA--C 1.532 1.141 0 CA-C-O 118.854 -0.97 . . . . 0.0 113.969 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.289 7.1 p 42.67 75.99 0.57 Allowed Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 127.043 2.137 . . . . 0.0 113.384 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -40.61 -44.33 4.48 Favored 'Trans proline' 0 C--N 1.354 0.841 1 C-N-CA 125.643 4.229 . . . . 0.0 117.941 -167.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -8.99 13.23 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.5 m -133.28 5.85 3.81 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.799 2.04 . . . . 0.0 113.217 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -66.88 138.97 95.43 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.577 1.151 . . . . 0.0 110.435 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -47.95 -40.1 32.73 Favored 'Trans proline' 0 CA--C 1.548 1.214 0 C-N-CA 123.278 2.652 . . . . 0.0 117.812 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -61.33 -19.47 64.19 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.36 2.707 . . . . 0.0 115.446 174.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -102.01 -1.7 31.23 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.119 1.368 . . . . 0.0 112.757 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.44 39.11 4.25 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.097 2.159 . . . . 0.0 115.595 175.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 CA--C 1.554 1.098 0 C-N-CA 126.327 1.851 . . . . 0.0 114.097 -177.97 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 120.435 0.16 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.405 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.8 t70 -114.04 -47.88 0.05 OUTLIER Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 125.135 1.374 . . . . 0.0 113.805 176.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.405 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 59.6 Cg_endo -74.16 -39.69 1.55 Allowed 'Trans proline' 0 C--N 1.357 1.02 0 CA-C-N 122.05 1.768 . . . . 0.0 112.957 176.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.87 35.22 1.42 Allowed 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 127.301 2.241 . . . . 0.0 114.822 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.35 -29.58 62.75 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.009 -1.057 . . . . 0.0 113.772 -175.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -146.72 0.38 0.76 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.564 1.146 . . . . 0.0 113.789 178.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.665 0 C-N-CA 124.309 1.044 . . . . 0.0 113.203 -177.267 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 . . . . . 0 N--CA 1.472 0.649 0 CA-C-O 120.346 0.117 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -73.67 -47.49 39.42 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.715 1.206 . . . . 0.0 114.024 -168.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -81.69 -29.66 32.94 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.564 0.746 . . . . 0.0 111.283 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.23 -44.68 89.08 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.058 0.837 . . . . 0.0 112.792 167.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.555 0 CA-C-N 118.031 0.915 . . . . 0.0 112.623 173.542 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.9 t70 . . . . . 0 CA--C 1.547 0.851 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -115.87 -15.38 11.26 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 172.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 71.8 t-105 -66.44 -51.65 54.63 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.312 0.96 . . . . 0.0 111.179 162.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 82.8 p -62.87 -19.48 64.2 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.59 -13.72 59.63 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 172.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.308 0 CA-C-O 117.724 -1.598 . . . . 0.0 116.11 -179.616 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 . . . . . 0 N--CA 1.479 1.018 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.97 31.92 2.61 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 125.968 1.707 . . . . 0.0 113.709 -170.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -93.78 -8.83 39.48 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.786 2.035 . . . . 0.0 113.084 -174.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.46 26.52 6.49 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.51 1.052 . . . . 0.0 113.325 -176.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.295 8.2 p 44.39 74.19 0.83 Allowed Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 127.45 2.3 . . . . 0.0 113.604 -177.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -41.91 -42.03 6.6 Favored 'Trans proline' 0 C--N 1.354 0.848 1 C-N-CA 125.375 4.05 . . . . 0.0 117.592 -171.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -9.24 37.47 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 177.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 61.0 m -133.47 -0.64 3.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.929 2.092 . . . . 0.0 113.736 176.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -54.44 138.52 59.49 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 126.116 1.766 . . . . 0.0 111.256 174.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -46.17 -41.1 21.83 Favored 'Trans proline' 0 CA--C 1.547 1.172 0 C-N-CA 123.696 2.931 . . . . 0.0 117.967 -176.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -61.97 -22.61 74.61 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 123.328 2.685 . . . . 0.0 115.078 175.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -96.42 -10.58 27.25 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.764 1.226 . . . . 0.0 112.954 172.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.2 40.76 5.28 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.738 2.015 . . . . 0.0 115.317 176.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 CA--C 1.553 1.075 0 C-N-CA 126.442 1.897 . . . . 0.0 114.703 -177.104 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.703 0.287 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.424 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.8 t70 -134.47 -48.69 0.03 OUTLIER Pre-proline 0 CA--C 1.548 0.895 0 CA-C-O 117.319 -1.324 . . . . 0.0 113.461 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.424 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 57.9 Cg_endo -72.59 -36.45 5.01 Favored 'Trans proline' 0 C--N 1.356 0.922 0 CA-C-N 121.872 1.704 . . . . 0.0 112.984 175.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.24 38.01 3.13 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 127.361 2.264 . . . . 0.0 114.911 174.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 99.0 mt -74.57 -27.7 60.61 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -175.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -147.46 -1.43 0.62 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.674 1.19 . . . . 0.0 113.837 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.627 0 O-C-N 121.057 -1.027 . . . . 0.0 113.235 -177.807 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 . . . . . 0 N--CA 1.471 0.593 0 CA-C-O 119.742 -0.17 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptm85 -71.1 -37.88 72.37 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 -167.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -93.15 -30.15 15.38 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.209 1.004 . . . . 0.0 111.621 177.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.33 -44.3 76.0 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 123.757 0.694 . . . . 0.0 112.606 166.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.609 0 CA-C-N 117.966 0.883 . . . . 0.0 113.042 174.438 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.5 t70 . . . . . 0 CA--C 1.549 0.925 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -119.31 -14.1 9.24 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -66.86 -49.08 66.81 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.8 1.182 . . . . 0.0 111.255 161.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 81.0 p -63.01 -15.68 57.25 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.29 -11.84 60.08 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 171.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.189 0 CA-C-O 117.677 -1.624 . . . . 0.0 116.626 -179.071 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 113.788 1.032 . . . . 0.0 113.788 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.09 44.97 19.5 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.139 1.376 . . . . 0.0 112.525 -170.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.3 tpt85 -123.93 17.06 9.35 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.934 2.494 . . . . 0.0 111.454 -165.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.68 22.06 62.68 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.452 1.025 . . . . 0.0 114.226 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.5 p 42.45 79.97 0.3 Allowed Pre-proline 0 N--CA 1.481 1.098 0 C-N-CA 127.055 2.142 . . . . 0.0 113.592 -174.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -40.6 -44.93 4.58 Favored 'Trans proline' 0 C--N 1.355 0.872 1 C-N-CA 125.659 4.24 . . . . 0.0 117.865 -169.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.0 -8.49 23.25 Favored 'General case' 0 CA--C 1.551 1.005 0 N-CA-C 115.705 1.742 . . . . 0.0 115.705 177.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.5 m -134.0 11.19 3.93 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 127.002 2.121 . . . . 0.0 113.017 176.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -65.89 141.01 97.43 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.401 1.081 . . . . 0.0 110.484 176.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -50.26 -40.05 52.35 Favored 'Trans proline' 0 CA--C 1.549 1.242 0 C-N-CA 122.713 2.275 . . . . 0.0 116.138 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -58.61 -20.39 49.95 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 124.258 3.305 . . . . 0.0 116.174 171.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -104.06 -3.95 23.89 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.377 1.471 . . . . 0.0 112.802 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.14 38.77 3.47 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.09 2.156 . . . . 0.0 115.286 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.8 mp . . . . . 0 CA--C 1.554 1.11 0 C-N-CA 126.475 1.91 . . . . 0.0 114.195 -177.593 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 110.505 -0.183 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -66.96 -48.07 51.58 Favored Pre-proline 0 CA--C 1.554 1.098 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 175.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.88 -35.85 1.3 Allowed 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 121.865 1.71 . . . . 0.0 113.496 -178.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 45.81 35.15 2.13 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 127.16 2.184 . . . . 0.0 114.886 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.4 mt -74.29 -27.39 60.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 -175.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -147.86 -4.55 0.49 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.672 0 O-C-N 121.112 -0.992 . . . . 0.0 113.501 -176.54 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.2 mtm180 . . . . . 0 N--CA 1.472 0.672 0 CA-C-O 120.363 0.125 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -73.2 -49.85 25.74 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.96 1.304 . . . . 0.0 114.014 -168.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -80.47 -30.05 37.46 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.75 0.82 . . . . 0.0 111.259 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.28 -44.4 89.37 Favored Glycine 0 CA--C 1.535 1.328 0 C-N-CA 123.896 0.76 . . . . 0.0 113.068 167.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.603 0 CA-C-N 118.164 0.982 . . . . 0.0 112.753 174.018 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 CA--C 1.548 0.89 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -118.52 -15.55 9.59 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 114.517 1.302 . . . . 0.0 114.517 172.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.3 t-105 -65.26 -50.6 65.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.588 1.085 . . . . 0.0 111.091 161.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.4 p -62.28 -20.52 64.38 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.04 -12.28 59.46 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 173.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.355 0 CA-C-O 117.942 -1.476 . . . . 0.0 115.818 -179.772 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 113.842 1.053 . . . . 0.0 113.842 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.48 42.33 14.31 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.442 1.497 . . . . 0.0 112.879 -171.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.1 tpt85 -122.73 15.93 10.22 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.355 2.262 . . . . 0.0 111.68 -168.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.6 26.51 42.33 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 124.4 1.0 . . . . 0.0 114.238 174.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.6 p 43.46 74.29 0.8 Allowed Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.702 2.001 . . . . 0.0 113.205 -176.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -41.36 -43.5 5.65 Favored 'Trans proline' 0 C--N 1.354 0.841 1 C-N-CA 125.453 4.102 . . . . 0.0 117.727 -169.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -9.54 22.25 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -133.2 5.65 3.82 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 126.577 1.951 . . . . 0.0 113.267 176.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -65.03 138.67 97.52 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.767 1.227 . . . . 0.0 110.608 174.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -47.61 -40.12 30.18 Favored 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 123.377 2.718 . . . . 0.0 117.653 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.02 -20.51 69.88 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.344 2.696 . . . . 0.0 115.23 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -99.02 -2.41 37.3 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.02 1.328 . . . . 0.0 112.707 172.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.71 37.66 3.54 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.08 2.152 . . . . 0.0 115.46 176.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp . . . . . 0 CA--C 1.554 1.132 0 C-N-CA 126.422 1.889 . . . . 0.0 114.045 -177.714 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 120.452 0.168 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.465 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 28.2 t70 -129.34 -47.28 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 125.334 1.454 . . . . 0.0 114.118 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 61.3 Cg_endo -73.35 -34.01 6.43 Favored 'Trans proline' 0 C--N 1.355 0.917 0 CA-C-N 122.037 1.763 . . . . 0.0 112.904 175.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 45.7 35.54 2.23 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 127.476 2.311 . . . . 0.0 115.014 173.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.71 -32.21 69.34 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -175.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -147.94 1.07 0.65 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.664 0 O-C-N 121.046 -1.034 . . . . 0.0 113.246 -176.811 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 . . . . . 0 N--CA 1.472 0.648 0 N-CA-C 110.788 -0.078 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -68.53 -49.41 59.78 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.783 1.233 . . . . 0.0 113.652 -168.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -83.36 -30.77 27.16 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.745 0.818 . . . . 0.0 111.365 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.46 -44.88 85.34 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.138 0.875 . . . . 0.0 113.011 169.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.626 0 CA-C-N 118.037 0.919 . . . . 0.0 112.83 174.515 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.5 t70 . . . . . 0 CA--C 1.547 0.837 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -115.35 -13.14 11.68 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 173.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.4 t-105 -67.1 -53.23 32.77 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.451 1.023 . . . . 0.0 111.125 159.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.0 p -63.43 -18.82 64.13 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.76 -16.47 57.93 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.679 1.191 . . . . 0.0 114.126 171.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.359 0 CA-C-O 118.15 -1.361 . . . . 0.0 115.335 177.418 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.76 42.99 16.54 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.392 1.477 . . . . 0.0 112.808 -172.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.8 tpt85 -120.61 8.8 10.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.77 2.428 . . . . 0.0 111.844 -166.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.52 21.95 59.27 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.581 1.086 . . . . 0.0 113.913 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.294 7.5 p 42.63 77.95 0.41 Allowed Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 127.121 2.168 . . . . 0.0 113.545 -177.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -39.87 -43.84 3.46 Favored 'Trans proline' 0 C--N 1.356 0.923 1 C-N-CA 125.954 4.436 . . . . 0.0 118.128 -166.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -9.4 20.99 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.715 1.746 . . . . 0.0 115.715 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.3 m -134.75 7.48 3.51 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.677 1.991 . . . . 0.0 113.118 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -63.13 138.87 97.45 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.83 1.252 . . . . 0.0 111.011 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.45 -40.91 29.46 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 123.427 2.751 . . . . 0.0 117.526 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -63.45 -22.32 71.24 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.237 2.625 . . . . 0.0 115.1 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -95.95 -10.86 27.61 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.734 1.214 . . . . 0.0 112.863 172.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.08 42.54 6.68 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.879 2.071 . . . . 0.0 115.018 177.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 CA--C 1.553 1.065 0 C-N-CA 126.576 1.951 . . . . 0.0 114.376 -178.399 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.1 mmt180 . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -68.74 -47.56 32.69 Favored Pre-proline 0 CA--C 1.553 1.08 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 173.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.76 -36.9 1.38 Allowed 'Trans proline' 0 C--N 1.357 1.008 0 CA-C-N 121.868 1.703 . . . . 0.0 113.299 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 44.68 35.6 1.48 Allowed 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 127.429 2.292 . . . . 0.0 115.149 176.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -70.72 -32.48 69.68 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -148.08 1.9 0.66 Allowed 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 178.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.658 0 C-N-CA 124.207 1.003 . . . . 0.0 113.293 -177.126 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.9 mtm180 . . . . . 0 N--CA 1.472 0.664 0 CA-C-O 120.041 -0.028 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -68.75 -50.69 48.48 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.453 1.101 . . . . 0.0 113.669 -169.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -81.43 -31.12 33.27 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.705 0.802 . . . . 0.0 111.386 177.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.45 -43.7 90.28 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 123.996 0.808 . . . . 0.0 113.239 169.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.592 0 CA-C-N 118.219 1.01 . . . . 0.0 112.782 174.482 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 t70 . . . . . 0 CA--C 1.549 0.909 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -117.77 -13.3 10.16 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 65.5 t-105 -65.37 -52.27 54.73 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.574 1.079 . . . . 0.0 110.911 158.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.1 p -62.66 -20.34 64.72 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.87 -14.87 56.84 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.285 0 CA-C-O 118.198 -1.335 . . . . 0.0 115.089 177.638 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.79 43.44 17.04 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.328 1.451 . . . . 0.0 112.708 -172.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -120.83 13.42 11.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.763 2.425 . . . . 0.0 111.501 -166.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.3 25.24 48.66 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.344 0.973 . . . . 0.0 114.015 177.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.276 7.4 p 44.25 76.47 0.53 Allowed Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.705 2.002 . . . . 0.0 113.326 -177.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -41.82 -43.49 6.73 Favored 'Trans proline' 0 C--N 1.354 0.816 1 C-N-CA 125.31 4.007 . . . . 0.0 117.501 -170.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -7.93 27.92 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 178.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.9 m -132.37 4.47 4.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.661 1.985 . . . . 0.0 113.31 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -65.18 138.65 97.34 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.986 1.314 . . . . 0.0 111.029 178.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -47.85 -41.01 32.46 Favored 'Trans proline' 0 CA--C 1.548 1.206 0 C-N-CA 123.488 2.792 . . . . 0.0 117.475 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.64 -20.8 71.9 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.342 2.695 . . . . 0.0 115.052 175.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -97.13 -3.15 41.64 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.918 1.287 . . . . 0.0 112.806 172.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 46.01 38.43 4.67 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.727 2.011 . . . . 0.0 115.028 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 CA--C 1.552 1.043 0 C-N-CA 126.393 1.877 . . . . 0.0 115.022 -174.939 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 110.811 -0.07 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -68.35 -48.06 36.1 Favored Pre-proline 0 CA--C 1.554 1.105 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 172.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -76.48 -42.2 0.38 Allowed 'Trans proline' 0 C--N 1.357 0.993 0 CA-C-N 121.924 1.723 . . . . 0.0 113.364 -178.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.74 33.93 1.07 Allowed 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 127.271 2.229 . . . . 0.0 114.907 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.4 mt -72.57 -31.02 64.91 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.985 -1.072 . . . . 0.0 113.601 -176.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -147.55 3.15 0.75 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.509 1.124 . . . . 0.0 113.891 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.681 0 O-C-N 121.029 -1.044 . . . . 0.0 113.269 -176.442 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.9 mtm180 . . . . . 0 N--CA 1.473 0.703 0 CA-C-O 120.387 0.137 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -67.23 -52.15 44.54 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.188 1.395 . . . . 0.0 113.792 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -80.94 -29.64 35.39 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.595 0.758 . . . . 0.0 111.48 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.9 -42.36 86.11 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.06 0.838 . . . . 0.0 113.209 168.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.657 0 CA-C-N 118.014 0.907 . . . . 0.0 112.927 173.667 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.8 t70 . . . . . 0 CA--C 1.547 0.853 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -112.66 -14.91 13.09 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 172.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -65.55 -52.68 50.63 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 119.41 1.004 . . . . 0.0 111.14 161.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.2 p -63.19 -20.83 65.77 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.65 -16.05 62.21 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 173.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.347 0 CA-C-O 118.327 -1.263 . . . . 0.0 115.064 177.989 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.14 45.69 19.66 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.117 1.367 . . . . 0.0 112.355 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.9 tpt85 -122.07 14.36 10.62 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.788 2.435 . . . . 0.0 111.657 -163.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.65 21.6 71.66 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-O 118.701 -1.055 . . . . 0.0 113.734 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.287 6.7 p 42.01 81.58 0.24 Allowed Pre-proline 0 N--CA 1.48 1.04 0 C-N-CA 127.406 2.283 . . . . 0.0 113.688 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -41.27 -43.43 5.43 Favored 'Trans proline' 0 C--N 1.354 0.839 1 C-N-CA 125.623 4.215 . . . . 0.0 118.085 -166.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -7.74 22.61 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 178.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.5 m -127.95 -3.53 5.79 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.476 1.91 . . . . 0.0 113.4 175.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -62.2 137.28 95.79 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.18 1.392 . . . . 0.0 111.044 175.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.02 -39.64 33.07 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.481 2.787 . . . . 0.0 117.662 -178.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -61.61 -17.3 53.55 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.488 2.792 . . . . 0.0 115.516 174.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -107.25 2.27 24.53 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.395 1.478 . . . . 0.0 112.709 172.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 42.76 47.13 4.64 Favored 'General case' 0 CA--C 1.55 0.981 0 C-N-CA 127.353 2.261 . . . . 0.0 115.881 172.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 18.8 mt . . . . . 0 N--CA 1.481 1.076 0 C-N-CA 125.808 1.643 . . . . 0.0 114.69 -179.817 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.56 0.219 . . . . 0.0 111.37 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.432 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 28.2 t70 -130.83 -47.9 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.983 0 C-N-CA 125.26 1.424 . . . . 0.0 114.138 -178.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.432 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 60.1 Cg_endo -73.2 -33.96 6.7 Favored 'Trans proline' 0 C--N 1.357 0.988 0 CA-C-N 122.211 1.825 . . . . 0.0 113.028 175.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.75 30.13 1.75 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.415 2.286 . . . . 0.0 115.355 175.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.15 -33.99 74.29 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.011 -1.056 . . . . 0.0 113.724 -175.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -149.04 2.17 0.57 Allowed 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.633 0 C-N-CA 124.415 1.086 . . . . 0.0 113.307 -176.854 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.0 mtm180 . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 120.153 0.025 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -69.35 -40.86 77.25 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -168.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -91.3 -29.15 17.31 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.146 0.979 . . . . 0.0 111.418 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.52 -42.99 77.63 Favored Glycine 0 CA--C 1.538 1.483 0 C-N-CA 123.908 0.766 . . . . 0.0 112.946 167.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.599 0 CA-C-N 117.987 0.894 . . . . 0.0 113.083 174.056 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 CA--C 1.547 0.851 0 N-CA-C 114.436 1.272 . . . . 0.0 114.436 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -115.8 -14.4 11.36 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 172.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -65.99 -51.95 53.83 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.529 1.059 . . . . 0.0 111.087 160.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.2 p -62.85 -19.0 63.7 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.83 -15.23 58.32 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.29 1.219 . . . . 0.0 114.29 172.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.313 0 CA-C-O 118.291 -1.283 . . . . 0.0 115.211 177.67 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.77 44.17 17.6 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.173 1.389 . . . . 0.0 112.522 -171.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.6 tpt85 -121.68 12.83 10.72 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 127.724 2.41 . . . . 0.0 111.662 -165.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.46 22.82 57.88 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.576 1.084 . . . . 0.0 114.056 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.286 7.3 p 43.34 77.32 0.45 Allowed Pre-proline 0 N--CA 1.479 1.018 0 C-N-CA 126.866 2.067 . . . . 0.0 113.392 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -40.57 -43.57 4.29 Favored 'Trans proline' 0 C--N 1.355 0.881 1 C-N-CA 125.61 4.207 . . . . 0.0 117.985 -167.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -9.48 20.44 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.3 m -134.08 6.14 3.61 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.688 1.995 . . . . 0.0 113.26 176.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -64.09 139.43 97.68 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 124.747 1.219 . . . . 0.0 110.704 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.19 -40.55 27.36 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 123.456 2.771 . . . . 0.0 117.623 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -62.34 -21.74 73.09 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.35 2.7 . . . . 0.0 115.194 174.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -98.44 -7.4 28.67 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.939 1.296 . . . . 0.0 112.782 172.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.79 40.92 4.62 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.028 2.131 . . . . 0.0 115.321 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.5 mp . . . . . 0 CA--C 1.553 1.059 0 C-N-CA 126.468 1.907 . . . . 0.0 114.225 -178.338 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 110.826 -0.064 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -74.01 -47.67 6.36 Favored Pre-proline 0 CA--C 1.553 1.091 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 174.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.66 -32.73 2.64 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 121.915 1.743 . . . . 0.0 113.526 -176.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.95 31.56 2.42 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 127.257 2.223 . . . . 0.0 115.583 174.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.35 -34.74 75.04 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -173.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -148.44 0.78 0.6 Allowed 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.704 0 C-N-CA 124.39 1.076 . . . . 0.0 113.504 -176.11 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 120.5 0.191 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -73.25 -46.81 47.85 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.946 1.298 . . . . 0.0 114.044 -168.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -82.05 -27.64 32.9 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.597 0.759 . . . . 0.0 111.243 175.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.23 -43.31 84.09 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 123.977 0.799 . . . . 0.0 113.172 166.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.688 0 CA-C-N 118.142 0.971 . . . . 0.0 113.103 174.201 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 CA--C 1.548 0.879 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -117.87 -10.84 10.37 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 172.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -68.0 -51.45 47.04 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.649 1.113 . . . . 0.0 111.065 158.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.8 p -63.18 -16.13 59.13 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.99 -13.73 58.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 171.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.287 0 CA-C-O 117.929 -1.484 . . . . 0.0 116.122 179.983 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.47 42.85 15.08 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.32 1.448 . . . . 0.0 112.785 -171.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.8 tpt85 -116.79 12.73 14.91 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.626 2.371 . . . . 0.0 111.732 -167.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.87 20.91 60.34 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 124.588 1.09 . . . . 0.0 113.937 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.4 p 41.61 77.89 0.41 Allowed Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 126.989 2.115 . . . . 0.0 113.245 -175.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -41.17 -41.26 4.52 Favored 'Trans proline' 0 C--N 1.354 0.863 1 C-N-CA 125.883 4.389 . . . . 0.0 118.496 -165.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -9.61 18.64 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 176.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 65.3 m -133.57 14.05 4.08 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.108 2.163 . . . . 0.0 112.917 177.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.58 140.35 96.45 Favored Pre-proline 0 CA--C 1.551 1.015 0 O-C-N 120.896 -1.128 . . . . 0.0 111.224 177.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -51.82 -39.97 66.89 Favored 'Trans proline' 0 CA--C 1.549 1.227 0 C-N-CA 122.941 2.427 . . . . 0.0 116.193 174.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -60.36 -21.63 68.04 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.484 2.79 . . . . 0.0 115.618 172.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -95.72 0.76 52.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.885 1.274 . . . . 0.0 112.629 171.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 47.03 33.95 2.56 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.909 2.084 . . . . 0.0 114.803 -177.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 CA--C 1.553 1.072 0 C-N-CA 126.477 1.911 . . . . 0.0 114.008 -175.831 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 110.727 -0.101 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -70.57 -49.39 15.72 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 173.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -79.8 -34.89 0.84 Allowed 'Trans proline' 0 C--N 1.357 0.976 0 CA-C-N 121.874 1.705 . . . . 0.0 113.684 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 43.32 37.95 1.52 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 127.295 2.238 . . . . 0.0 113.982 -176.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.6 -39.3 77.35 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.494 1.118 . . . . 0.0 112.562 -171.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -143.99 2.67 1.19 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.812 1.245 . . . . 0.0 113.534 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.682 0 O-C-N 120.969 -1.082 . . . . 0.0 113.414 -176.38 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 120.421 0.153 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -69.64 -53.7 17.46 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.223 1.409 . . . . 0.0 113.801 -169.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -77.44 -31.14 53.68 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.645 0.778 . . . . 0.0 111.427 177.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -57.2 -42.76 93.52 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.141 0.877 . . . . 0.0 113.364 169.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.61 0 CA-C-N 118.183 0.992 . . . . 0.0 112.776 173.857 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 . . . . . 0 CA--C 1.549 0.91 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -113.54 -13.31 12.79 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 172.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.8 t-105 -67.49 -51.8 46.85 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.475 1.034 . . . . 0.0 111.192 160.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.6 p -63.51 -17.9 63.25 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.422 1.268 . . . . 0.0 114.422 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.85 -16.17 57.45 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.681 1.192 . . . . 0.0 114.192 171.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.295 0 C-N-CA 124.862 1.22 . . . . 0.0 114.85 175.821 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.63 43.66 16.6 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.242 1.417 . . . . 0.0 112.581 -170.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -117.57 10.47 13.48 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 127.502 2.321 . . . . 0.0 112.086 -165.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.96 21.52 65.52 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 118.805 -0.997 . . . . 0.0 113.676 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.288 7.2 p 40.16 78.54 0.36 Allowed Pre-proline 0 N--CA 1.48 1.05 0 C-N-CA 127.3 2.24 . . . . 0.0 113.513 -177.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -40.1 -41.86 3.24 Favored 'Trans proline' 0 C--N 1.355 0.897 1 C-N-CA 126.091 4.527 . . . . 0.0 118.71 -164.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -9.33 12.55 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 177.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.9 m -129.32 9.17 5.59 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.517 1.927 . . . . 0.0 113.004 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -70.49 140.04 87.03 Favored Pre-proline 0 CA--C 1.551 0.992 0 O-C-N 120.94 -1.1 . . . . 0.0 111.301 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -51.3 -39.79 62.32 Favored 'Trans proline' 0 CA--C 1.548 1.207 0 C-N-CA 123.177 2.585 . . . . 0.0 116.511 175.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -60.07 -20.38 60.68 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.548 2.832 . . . . 0.0 115.709 172.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.16 2.16 42.73 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.045 1.338 . . . . 0.0 112.575 172.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 46.29 37.06 3.74 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.721 2.009 . . . . 0.0 114.653 -178.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.2 mp . . . . . 0 CA--C 1.553 1.075 0 C-N-CA 126.413 1.885 . . . . 0.0 114.104 -176.859 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 120.44 0.162 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.407 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.7 t70 -113.23 -48.15 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.085 1.354 . . . . 0.0 113.65 176.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.407 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 69.7 Cg_endo -75.7 -36.39 2.18 Favored 'Trans proline' 0 C--N 1.357 0.98 0 CA-C-N 122.049 1.767 . . . . 0.0 113.112 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 43.01 37.97 1.29 Allowed 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 127.544 2.337 . . . . 0.0 114.713 178.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 98.2 mt -70.91 -32.45 69.38 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -148.63 3.29 0.64 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.686 0 O-C-N 121.025 -1.047 . . . . 0.0 113.195 -176.918 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 . . . . . 0 N--CA 1.474 0.727 0 CA-C-O 120.168 0.032 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -68.69 -48.06 64.86 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.875 1.27 . . . . 0.0 114.153 -169.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -83.77 -29.53 27.35 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.803 0.841 . . . . 0.0 111.408 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.57 -41.93 89.72 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 123.999 0.809 . . . . 0.0 113.172 168.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.584 0 CA-C-N 118.142 0.971 . . . . 0.0 112.834 173.892 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 CA--C 1.548 0.887 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -114.17 -11.55 12.64 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 172.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -68.4 -53.49 23.47 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.48 1.036 . . . . 0.0 110.995 158.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.9 p -63.63 -17.62 63.09 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.37 -16.37 54.18 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.325 1.232 . . . . 0.0 114.325 171.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.288 0 CA-C-O 118.034 -1.426 . . . . 0.0 115.671 178.172 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.26 45.12 20.14 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.98 1.312 . . . . 0.0 112.44 -170.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -121.85 12.81 10.59 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 127.938 2.495 . . . . 0.0 111.736 -164.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.6 20.53 68.56 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.519 1.057 . . . . 0.0 114.003 -178.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.292 7.6 p 43.35 80.1 0.3 Allowed Pre-proline 0 N--CA 1.48 1.031 0 C-N-CA 127.167 2.187 . . . . 0.0 113.499 -176.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -41.04 -43.74 4.96 Favored 'Trans proline' 0 C--N 1.355 0.898 1 C-N-CA 125.721 4.281 . . . . 0.0 117.882 -167.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -7.48 20.25 Favored 'General case' 0 CA--C 1.551 1.018 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 178.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.1 m -130.73 -3.24 4.16 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.475 1.91 . . . . 0.0 113.513 175.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.17 138.77 91.48 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 125.69 1.596 . . . . 0.0 111.498 178.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -46.93 -38.93 24.31 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 123.598 2.865 . . . . 0.0 117.997 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -63.17 -20.66 71.47 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.365 2.71 . . . . 0.0 115.171 173.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -103.44 -13.29 16.68 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.147 1.379 . . . . 0.0 112.888 172.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.37 51.43 7.68 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 127.103 2.161 . . . . 0.0 115.039 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 32.9 mt . . . . . 0 N--CA 1.48 1.064 0 C-N-CA 126.36 1.864 . . . . 0.0 114.899 -179.526 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 120.896 0.379 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.417 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.9 t70 -131.89 -48.43 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.309 1.444 . . . . 0.0 113.93 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.417 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 57.1 Cg_endo -72.95 -38.47 2.89 Favored 'Trans proline' 0 C--N 1.356 0.923 0 CA-C-N 122.137 1.799 . . . . 0.0 112.801 174.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.58 36.22 2.46 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 127.309 2.244 . . . . 0.0 114.645 176.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.9 mt -76.4 -24.35 54.05 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -176.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -147.36 -1.62 0.62 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.667 0 O-C-N 121.028 -1.045 . . . . 0.0 113.413 -177.513 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 120.527 0.203 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -71.38 -34.57 70.54 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -168.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -99.27 -27.36 13.82 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.474 1.109 . . . . 0.0 111.337 176.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.4 -40.02 75.32 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.753 0.692 . . . . 0.0 112.894 164.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.646 0 CA-C-N 118.083 0.941 . . . . 0.0 112.933 172.533 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.5 t70 . . . . . 0 CA--C 1.55 0.963 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -120.63 -11.72 9.01 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 70.8 t-105 -65.3 -50.17 66.71 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.664 1.12 . . . . 0.0 110.91 159.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.5 p -62.03 -16.63 53.23 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.19 -13.9 61.01 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 171.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.394 0 CA-C-O 117.874 -1.514 . . . . 0.0 116.14 179.806 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.78 45.21 18.37 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.392 1.477 . . . . 0.0 112.385 -171.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 tpt85 -124.93 15.06 8.56 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 127.963 2.505 . . . . 0.0 111.638 -163.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.3 16.83 68.13 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.724 1.154 . . . . 0.0 114.195 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.303 6.8 p 44.81 80.08 0.31 Allowed Pre-proline 0 N--CA 1.479 1.013 0 C-N-CA 127.07 2.148 . . . . 0.0 113.124 -173.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -41.72 -43.39 6.49 Favored 'Trans proline' 0 C--N 1.356 0.921 1 C-N-CA 125.553 4.169 . . . . 0.0 118.125 -169.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -6.56 20.73 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 177.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.4 m -133.06 12.58 4.28 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.968 2.107 . . . . 0.0 112.956 176.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -68.66 141.1 92.47 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.829 1.251 . . . . 0.0 111.1 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -52.84 -40.37 75.13 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 123.237 2.625 . . . . 0.0 115.222 172.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -56.85 -19.21 30.57 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.937 3.091 . . . . 0.0 116.463 169.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -106.47 2.83 26.63 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.155 1.382 . . . . 0.0 112.829 173.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.64 47.19 8.62 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.775 2.03 . . . . 0.0 114.676 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.9 mt . . . . . 0 N--CA 1.479 0.987 0 C-N-CA 126.462 1.905 . . . . 0.0 114.894 -177.892 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.547 0.213 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -129.56 -48.95 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.201 1.4 . . . . 0.0 113.733 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -73.4 -38.71 2.42 Favored 'Trans proline' 0 C--N 1.357 1.011 0 CA-C-N 122.034 1.762 . . . . 0.0 112.745 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.72 34.69 1.87 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 127.294 2.238 . . . . 0.0 114.669 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.4 mt -76.25 -26.22 55.77 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -147.49 0.62 0.69 Allowed 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 -177.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.709 0 C-N-CA 124.364 1.065 . . . . 0.0 113.212 -177.301 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 . . . . . 0 N--CA 1.473 0.687 0 CA-C-O 120.021 -0.038 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -71.23 -30.35 66.24 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 -167.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -102.81 -28.8 11.85 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.799 1.24 . . . . 0.0 111.333 174.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.3 -41.97 81.21 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.741 0.686 . . . . 0.0 112.948 166.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.517 0 CA-C-N 118.06 0.93 . . . . 0.0 113.021 174.32 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 CA--C 1.549 0.904 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -117.77 -13.69 10.15 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 171.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -66.71 -50.03 64.13 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.668 1.122 . . . . 0.0 110.924 159.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.5 p -63.93 -13.74 48.09 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.3 -12.14 59.36 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 170.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.302 0 CA-C-O 117.786 -1.563 . . . . 0.0 116.16 -179.791 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 . . . . . 0 N--CA 1.48 1.044 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.18 42.01 16.68 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.437 1.495 . . . . 0.0 113.043 -172.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.2 tpt85 -120.29 8.49 10.86 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.509 2.324 . . . . 0.0 112.102 -168.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.6 20.83 53.24 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.774 1.178 . . . . 0.0 114.212 176.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.296 7.2 p 43.5 77.68 0.43 Allowed Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 126.82 2.048 . . . . 0.0 113.441 -174.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -41.18 -42.82 5.1 Favored 'Trans proline' 0 C--N 1.355 0.91 1 C-N-CA 125.724 4.283 . . . . 0.0 118.051 -168.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -9.48 24.28 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 177.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.9 m -134.09 11.96 3.91 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.659 1.984 . . . . 0.0 112.91 176.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -64.37 140.82 98.05 Favored Pre-proline 0 CA--C 1.548 0.881 0 O-C-N 120.885 -1.134 . . . . 0.0 111.089 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -53.15 -41.51 71.57 Favored 'Trans proline' 0 CA--C 1.55 1.322 0 C-N-CA 122.424 2.083 . . . . 0.0 115.482 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -54.83 -22.22 28.91 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 124.222 3.281 . . . . 0.0 116.764 169.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -100.19 -6.17 26.53 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.572 1.149 . . . . 0.0 113.114 173.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.87 45.48 8.51 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.359 1.864 . . . . 0.0 114.595 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.479 1.016 0 C-N-CA 126.859 2.063 . . . . 0.0 115.16 -177.348 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 120.625 0.25 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -135.45 -49.86 0.02 OUTLIER Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.086 1.355 . . . . 0.0 113.684 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -73.58 -34.2 5.91 Favored 'Trans proline' 0 C--N 1.358 1.034 0 CA-C-N 121.975 1.741 . . . . 0.0 113.035 174.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 43.54 38.35 1.83 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 127.508 2.323 . . . . 0.0 114.195 178.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.85 -30.67 62.8 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.272 1.029 . . . . 0.0 113.23 -173.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -145.54 -0.77 0.83 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.695 0 O-C-N 121.029 -1.045 . . . . 0.0 113.365 -176.957 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.7 mtm180 . . . . . 0 N--CA 1.474 0.757 0 CA-C-O 120.377 0.132 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -72.08 -43.84 64.21 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.267 1.427 . . . . 0.0 114.568 -169.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -88.22 -27.05 22.05 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.998 0.919 . . . . 0.0 111.48 175.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.24 -43.0 89.31 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 123.612 0.625 . . . . 0.0 112.76 165.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.525 0 CA-C-N 118.048 0.924 . . . . 0.0 112.988 173.651 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.2 t70 . . . . . 0 CA--C 1.548 0.897 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -119.7 -15.43 8.93 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 172.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -67.05 -50.38 62.1 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.387 0.994 . . . . 0.0 111.125 162.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.1 p -63.32 -19.59 64.74 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.9 -14.14 58.85 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 172.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.318 0 CA-C-O 118.008 -1.44 . . . . 0.0 115.377 178.145 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.34 43.52 19.34 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.152 1.381 . . . . 0.0 112.649 -172.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -122.54 9.61 9.65 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.84 2.456 . . . . 0.0 111.887 -164.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.44 21.76 53.22 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.592 1.091 . . . . 0.0 114.233 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.294 7.1 p 43.83 76.01 0.58 Allowed Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 126.804 2.042 . . . . 0.0 113.235 -176.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -40.72 -43.21 4.42 Favored 'Trans proline' 0 C--N 1.355 0.877 1 C-N-CA 125.763 4.309 . . . . 0.0 117.974 -167.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -9.87 18.61 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.0 m -131.81 3.29 4.11 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.3 1.84 . . . . 0.0 113.464 175.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -64.95 138.87 97.62 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 124.95 1.3 . . . . 0.0 111.17 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -47.63 -40.36 30.51 Favored 'Trans proline' 0 CA--C 1.548 1.213 0 C-N-CA 123.651 2.901 . . . . 0.0 117.705 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -61.65 -20.61 69.51 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.411 2.74 . . . . 0.0 115.202 174.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -99.52 -2.53 35.62 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.925 1.29 . . . . 0.0 112.776 172.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.81 38.69 4.55 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.755 2.022 . . . . 0.0 115.137 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 CA--C 1.553 1.066 0 C-N-CA 126.337 1.855 . . . . 0.0 114.484 -176.552 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 120.6 0.238 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.421 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.0 t70 -128.41 -48.51 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.235 1.414 . . . . 0.0 113.816 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.421 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.7 Cg_endo -73.49 -38.84 2.29 Favored 'Trans proline' 0 C--N 1.356 0.921 0 CA-C-N 122.086 1.781 . . . . 0.0 112.71 174.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.43 34.92 1.71 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 127.315 2.246 . . . . 0.0 114.728 177.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.5 mt -75.56 -26.15 57.71 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.04 -1.037 . . . . 0.0 113.704 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -147.89 -0.93 0.6 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -178.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.697 0 O-C-N 121.096 -1.002 . . . . 0.0 113.325 -176.803 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.2 mtm180 . . . . . 0 N--CA 1.472 0.675 0 CA-C-O 120.486 0.184 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -69.82 -40.03 76.13 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.238 1.415 . . . . 0.0 114.538 -168.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -93.63 -29.59 15.38 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.393 1.077 . . . . 0.0 111.249 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.46 -41.33 80.47 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 123.876 0.75 . . . . 0.0 113.184 168.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.656 0 CA-C-N 118.072 0.936 . . . . 0.0 112.807 173.099 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.3 t70 . . . . . 0 CA--C 1.549 0.911 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -121.75 -19.0 6.94 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 171.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -62.0 -47.58 84.15 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.624 1.102 . . . . 0.0 111.308 164.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.0 p -61.97 -24.96 67.33 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.14 -5.91 42.25 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.333 0 C-N-CA 124.941 1.258 . . . . 0.0 114.558 177.105 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.44 40.72 15.48 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.667 1.587 . . . . 0.0 113.339 -173.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -113.12 11.96 18.99 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 127.167 2.187 . . . . 0.0 111.969 -171.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.96 26.02 35.85 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 118.911 -0.938 . . . . 0.0 113.921 175.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.283 8.8 p 43.63 72.95 1.04 Allowed Pre-proline 0 N--CA 1.48 1.028 0 C-N-CA 126.644 1.978 . . . . 0.0 113.359 -177.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -41.54 -41.81 5.62 Favored 'Trans proline' 0 C--N 1.355 0.881 1 C-N-CA 125.64 4.227 . . . . 0.0 117.9 -168.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -10.1 21.62 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 115.666 1.728 . . . . 0.0 115.666 177.629 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.9 m -133.36 3.26 3.61 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.222 1.809 . . . . 0.0 113.666 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -61.86 138.75 95.57 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.02 1.328 . . . . 0.0 111.148 176.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -47.01 -40.86 26.22 Favored 'Trans proline' 0 CA--C 1.548 1.217 0 C-N-CA 123.64 2.893 . . . . 0.0 117.79 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.47 -21.14 72.39 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.24 2.626 . . . . 0.0 115.043 175.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -97.29 -6.63 33.98 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.859 1.263 . . . . 0.0 112.81 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.34 40.26 5.15 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 126.964 2.105 . . . . 0.0 115.104 177.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.1 mp . . . . . 0 CA--C 1.553 1.067 0 C-N-CA 126.564 1.945 . . . . 0.0 115.007 -175.257 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 120.588 0.233 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -132.19 -49.09 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.993 0 CA-C-O 117.208 -1.377 . . . . 0.0 113.845 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -73.18 -38.25 2.86 Favored 'Trans proline' 0 C--N 1.357 0.997 0 CA-C-N 122.14 1.8 . . . . 0.0 112.729 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.45 33.31 1.89 Allowed 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 127.244 2.218 . . . . 0.0 114.799 175.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.3 mt -73.69 -28.2 61.62 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.074 -1.016 . . . . 0.0 113.563 -176.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -148.06 2.08 0.67 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.702 0 O-C-N 121.118 -0.988 . . . . 0.0 113.182 -177.187 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 110.86 -0.052 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -66.77 -46.06 76.53 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.862 1.265 . . . . 0.0 114.205 -169.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -88.72 -30.16 19.29 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.128 0.971 . . . . 0.0 111.407 177.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.33 -42.67 89.26 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 123.889 0.757 . . . . 0.0 113.17 170.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.598 0 CA-C-N 118.074 0.937 . . . . 0.0 112.833 173.819 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 t70 . . . . . 0 CA--C 1.547 0.846 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -116.27 -13.41 11.08 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 172.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -67.46 -52.01 44.48 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.489 1.041 . . . . 0.0 111.021 160.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.2 p -62.56 -19.22 63.46 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.45 -13.82 53.64 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 171.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.289 0 CA-C-O 117.836 -1.536 . . . . 0.0 115.722 179.393 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 . . . . . 0 N--CA 1.479 0.983 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.82 37.02 6.54 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.571 1.549 . . . . 0.0 113.106 -171.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 48.5 tpt85 -102.71 -13.62 17.0 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.514 2.326 . . . . 0.0 113.059 -169.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.74 21.29 8.75 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.947 1.261 . . . . 0.0 113.759 -175.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.299 7.7 p 44.86 80.23 0.3 Allowed Pre-proline 0 N--CA 1.48 1.055 0 C-N-CA 127.345 2.258 . . . . 0.0 113.783 -177.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -42.66 -42.33 8.5 Favored 'Trans proline' 0 C--N 1.354 0.862 1 C-N-CA 125.57 4.18 . . . . 0.0 117.961 -170.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -5.94 18.71 Favored 'General case' 0 CA--C 1.551 1.018 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.4 m -134.33 12.26 3.84 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 127.221 2.208 . . . . 0.0 112.713 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -65.26 143.59 98.82 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 125.066 1.346 . . . . 0.0 111.931 -177.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.57 -39.6 74.75 Favored 'Trans proline' 0 CA--C 1.548 1.212 0 C-N-CA 123.041 2.494 . . . . 0.0 116.214 173.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -60.02 -20.54 61.14 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.668 2.912 . . . . 0.0 115.602 170.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -99.02 6.67 46.54 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.449 1.5 . . . . 0.0 112.321 171.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 48.46 32.63 3.44 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 127.202 2.201 . . . . 0.0 115.123 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.555 1.165 0 C-N-CA 125.587 1.555 . . . . 0.0 113.597 -174.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -68.13 -49.63 33.95 Favored Pre-proline 0 CA--C 1.554 1.108 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 175.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.48 -42.97 0.19 Allowed 'Trans proline' 0 C--N 1.356 0.948 0 CA-C-N 121.845 1.695 . . . . 0.0 113.461 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.2 32.86 1.58 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 126.968 2.107 . . . . 0.0 114.396 -176.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.6 mt -79.01 -22.51 45.38 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -177.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -146.57 -1.89 0.68 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.645 0 C-N-CA 124.338 1.055 . . . . 0.0 113.297 -177.624 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.7 mtm180 . . . . . 0 N--CA 1.473 0.678 0 CA-C-O 120.216 0.055 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -68.89 -19.26 64.22 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -167.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -120.9 -33.56 3.73 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.677 1.591 . . . . 0.0 111.297 176.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.64 -41.26 97.3 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.077 0.846 . . . . 0.0 113.813 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.597 0 CA-C-N 118.488 1.144 . . . . 0.0 112.682 174.196 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 CA--C 1.547 0.851 0 N-CA-C 114.617 1.339 . . . . 0.0 114.617 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -111.27 -14.97 13.73 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 173.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 70.9 t-105 -67.56 -52.43 38.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.571 1.078 . . . . 0.0 110.906 160.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.3 p -63.32 -19.15 64.35 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.1 -16.92 61.57 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 171.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.338 0 CA-C-O 118.209 -1.329 . . . . 0.0 114.895 176.862 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.92 43.38 17.54 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.211 1.405 . . . . 0.0 112.569 -170.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -121.03 8.22 10.4 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.593 2.357 . . . . 0.0 112.11 -165.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.44 21.44 58.36 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.567 1.08 . . . . 0.0 114.044 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.293 7.1 p 40.47 77.95 0.4 Allowed Pre-proline 0 N--CA 1.481 1.105 0 C-N-CA 127.086 2.154 . . . . 0.0 113.411 -177.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -40.05 -42.26 3.29 Favored 'Trans proline' 0 C--N 1.356 0.949 1 C-N-CA 126.032 4.488 . . . . 0.0 118.481 -163.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -8.88 7.95 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.71 1.745 . . . . 0.0 115.71 177.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.5 m -127.46 7.57 6.39 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.298 1.839 . . . . 0.0 113.107 176.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -74.15 142.12 78.56 Favored Pre-proline 0 CA--C 1.554 1.116 0 O-C-N 120.909 -1.12 . . . . 0.0 111.477 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -51.58 -38.42 65.08 Favored 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 123.35 2.7 . . . . 0.0 116.992 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -60.06 -20.4 60.68 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.609 2.873 . . . . 0.0 115.447 171.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -102.29 10.0 39.51 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.437 1.495 . . . . 0.0 112.059 171.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 48.47 33.46 4.01 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.129 2.172 . . . . 0.0 115.068 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.555 1.145 0 C-N-CA 125.512 1.525 . . . . 0.0 113.503 -175.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 120.488 0.185 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.429 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.5 t70 -129.03 -48.44 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 125.312 1.445 . . . . 0.0 113.995 178.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.429 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 72.9 Cg_endo -74.77 -30.02 8.04 Favored 'Trans proline' 0 C--N 1.356 0.935 0 CA-C-N 121.984 1.744 . . . . 0.0 112.99 174.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 43.21 43.56 4.04 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.727 2.411 . . . . 0.0 114.717 171.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.4 mt -68.82 -37.12 78.98 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -174.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -149.3 3.62 0.59 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.553 1.141 . . . . 0.0 114.054 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.64 -33.87 68.74 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.958 -1.089 . . . . 0.0 113.507 -176.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.3 mtm180 -95.59 -64.54 1.05 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.211 1.004 . . . . 0.0 111.044 171.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -72.04 -33.69 68.2 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -167.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -97.29 -29.86 13.3 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.301 1.041 . . . . 0.0 111.086 175.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -57.28 -41.76 93.15 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.104 0.859 . . . . 0.0 113.359 169.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.4 -44.4 75.14 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 118.013 0.906 . . . . 0.0 112.816 172.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.38 -18.45 61.57 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.271 1.428 . . . . 0.0 114.418 174.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -113.48 -11.83 13.02 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 173.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -67.15 -53.82 27.04 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.369 0.986 . . . . 0.0 110.918 158.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.9 p -63.54 -18.76 64.19 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.54 -16.53 56.52 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 171.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.26 -23.57 0.34 Allowed Glycine 0 CA--C 1.534 1.242 0 CA-C-O 118.255 -1.303 . . . . 0.0 115.134 178.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 68.68 21.48 7.85 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.139 1.776 . . . . 0.0 113.889 -165.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.69 41.05 13.15 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.591 1.556 . . . . 0.0 112.89 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.4 tpt85 -112.92 6.68 17.96 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 127.609 2.364 . . . . 0.0 112.142 -169.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.13 22.23 59.5 Favored Glycine 0 CA--C 1.532 1.146 0 CA-C-O 118.687 -1.063 . . . . 0.0 113.761 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.288 7.1 p 40.4 77.98 0.39 Allowed Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 127.308 2.243 . . . . 0.0 113.441 -177.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -39.09 -44.54 2.62 Favored 'Trans proline' 0 C--N 1.355 0.895 1 C-N-CA 126.101 4.534 . . . . 0.0 118.417 -164.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -9.9 9.29 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 178.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.7 m -129.9 7.59 5.17 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.512 1.925 . . . . 0.0 113.044 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -71.41 140.06 84.6 Favored Pre-proline 0 CA--C 1.554 1.104 0 O-C-N 121.023 -1.048 . . . . 0.0 110.523 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -48.24 -39.29 34.63 Favored 'Trans proline' 0 CA--C 1.549 1.23 0 C-N-CA 123.492 2.795 . . . . 0.0 117.66 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -61.22 -18.63 59.68 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 123.481 2.787 . . . . 0.0 115.419 173.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -104.23 4.39 33.8 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.517 1.527 . . . . 0.0 112.532 172.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.52 46.7 8.22 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.2 2.2 . . . . 0.0 115.56 173.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.6 mt 59.91 16.77 5.99 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 126.258 1.823 . . . . 0.0 114.731 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 O-C-N 119.585 -1.947 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 120.607 0.242 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -133.65 -49.05 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.169 1.388 . . . . 0.0 113.796 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -73.03 -33.86 7.05 Favored 'Trans proline' 0 C--N 1.357 0.977 0 CA-C-N 122.06 1.771 . . . . 0.0 112.918 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.48 39.53 3.26 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 127.566 2.346 . . . . 0.0 114.873 172.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.5 mt -72.32 -31.74 65.93 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -175.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -148.38 2.93 0.66 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.91 -33.54 68.87 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.99 -1.069 . . . . 0.0 113.42 -177.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.0 mtm180 -98.36 -64.7 1.02 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.323 1.049 . . . . 0.0 110.998 170.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -72.83 -19.03 61.4 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 -167.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -117.3 -28.37 6.17 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.493 1.517 . . . . 0.0 111.339 176.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.88 -41.04 91.23 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.042 0.829 . . . . 0.0 113.22 167.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.44 -43.68 84.96 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.054 0.927 . . . . 0.0 112.811 172.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.11 -17.21 63.22 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.353 1.461 . . . . 0.0 114.446 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -113.27 -13.87 12.9 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 172.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -66.76 -53.37 33.78 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.46 1.027 . . . . 0.0 111.001 160.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.1 p -62.56 -18.65 62.5 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.02 -14.63 60.9 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 171.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -145.62 -17.29 0.17 Allowed Glycine 0 CA--C 1.535 1.294 0 CA-C-O 118.021 -1.433 . . . . 0.0 115.975 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 68.29 19.45 9.0 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.502 1.921 . . . . 0.0 113.868 -165.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.31 43.98 15.61 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 125.375 1.47 . . . . 0.0 112.674 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.1 tpt85 -121.86 19.02 11.01 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.651 2.38 . . . . 0.0 111.341 -166.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.14 23.15 61.79 Favored Glycine 0 CA--C 1.532 1.141 0 CA-C-O 118.854 -0.97 . . . . 0.0 113.969 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.289 7.1 p 42.67 75.99 0.57 Allowed Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 127.043 2.137 . . . . 0.0 113.384 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -40.61 -44.33 4.48 Favored 'Trans proline' 0 C--N 1.354 0.841 1 C-N-CA 125.643 4.229 . . . . 0.0 117.941 -167.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -8.99 13.23 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.5 m -133.28 5.85 3.81 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.799 2.04 . . . . 0.0 113.217 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -66.88 138.97 95.43 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.577 1.151 . . . . 0.0 110.435 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -47.95 -40.1 32.73 Favored 'Trans proline' 0 CA--C 1.548 1.214 0 C-N-CA 123.278 2.652 . . . . 0.0 117.812 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -61.33 -19.47 64.19 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.36 2.707 . . . . 0.0 115.446 174.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -102.01 -1.7 31.23 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.119 1.368 . . . . 0.0 112.757 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.44 39.11 4.25 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.097 2.159 . . . . 0.0 115.595 175.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.1 mp 59.08 19.06 6.92 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.327 1.851 . . . . 0.0 114.097 -177.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.287 0 O-C-N 119.423 -2.048 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 120.435 0.16 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.405 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.8 t70 -114.04 -47.88 0.05 OUTLIER Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 125.135 1.374 . . . . 0.0 113.805 176.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.405 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 59.6 Cg_endo -74.16 -39.69 1.55 Allowed 'Trans proline' 0 C--N 1.357 1.02 0 CA-C-N 122.05 1.768 . . . . 0.0 112.957 176.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.87 35.22 1.42 Allowed 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 127.301 2.241 . . . . 0.0 114.822 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.35 -29.58 62.75 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.009 -1.057 . . . . 0.0 113.772 -175.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -146.72 0.38 0.76 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.564 1.146 . . . . 0.0 113.789 178.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.36 -33.87 70.04 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.309 1.044 . . . . 0.0 113.203 -177.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -89.66 -64.63 1.11 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.785 0.834 . . . . 0.0 110.852 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -73.67 -47.49 39.42 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.715 1.206 . . . . 0.0 114.024 -168.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -81.69 -29.66 32.94 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.564 0.746 . . . . 0.0 111.283 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.23 -44.68 89.08 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.058 0.837 . . . . 0.0 112.792 167.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.84 -47.06 82.29 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.031 0.915 . . . . 0.0 112.623 173.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -65.33 -17.2 64.33 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 177.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -115.87 -15.38 11.26 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 172.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 71.8 t-105 -66.44 -51.65 54.63 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.312 0.96 . . . . 0.0 111.179 162.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 82.8 p -62.87 -19.48 64.2 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.59 -13.72 59.63 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 172.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.98 -18.05 0.18 Allowed Glycine 0 CA--C 1.535 1.308 0 CA-C-O 117.724 -1.598 . . . . 0.0 116.11 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 60.96 21.85 12.11 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.43 1.492 . . . . 0.0 113.528 -164.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.97 31.92 2.61 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 125.968 1.707 . . . . 0.0 113.709 -170.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -93.78 -8.83 39.48 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.786 2.035 . . . . 0.0 113.084 -174.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.46 26.52 6.49 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.51 1.052 . . . . 0.0 113.325 -176.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.295 8.2 p 44.39 74.19 0.83 Allowed Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 127.45 2.3 . . . . 0.0 113.604 -177.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -41.91 -42.03 6.6 Favored 'Trans proline' 0 C--N 1.354 0.848 1 C-N-CA 125.375 4.05 . . . . 0.0 117.592 -171.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -9.24 37.47 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 177.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 61.0 m -133.47 -0.64 3.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.929 2.092 . . . . 0.0 113.736 176.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -54.44 138.52 59.49 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 126.116 1.766 . . . . 0.0 111.256 174.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -46.17 -41.1 21.83 Favored 'Trans proline' 0 CA--C 1.547 1.172 0 C-N-CA 123.696 2.931 . . . . 0.0 117.967 -176.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -61.97 -22.61 74.61 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 123.328 2.685 . . . . 0.0 115.078 175.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -96.42 -10.58 27.25 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.764 1.226 . . . . 0.0 112.954 172.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.2 40.76 5.28 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.738 2.015 . . . . 0.0 115.317 176.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.1 mp 58.75 16.9 4.74 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.442 1.897 . . . . 0.0 114.703 -177.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.355 0 O-C-N 119.36 -2.088 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.703 0.287 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.424 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.8 t70 -134.47 -48.69 0.03 OUTLIER Pre-proline 0 CA--C 1.548 0.895 0 CA-C-O 117.319 -1.324 . . . . 0.0 113.461 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.424 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 57.9 Cg_endo -72.59 -36.45 5.01 Favored 'Trans proline' 0 C--N 1.356 0.922 0 CA-C-N 121.872 1.704 . . . . 0.0 112.984 175.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.24 38.01 3.13 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 127.361 2.264 . . . . 0.0 114.911 174.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 99.0 mt -74.57 -27.7 60.61 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -175.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -147.46 -1.43 0.62 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.674 1.19 . . . . 0.0 113.837 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.32 -34.11 68.4 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.057 -1.027 . . . . 0.0 113.235 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 -99.19 -63.07 1.16 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.349 1.059 . . . . 0.0 110.952 171.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptm85 -71.1 -37.88 72.37 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 -167.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -93.15 -30.15 15.38 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.209 1.004 . . . . 0.0 111.621 177.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.33 -44.3 76.0 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 123.757 0.694 . . . . 0.0 112.606 166.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.93 -46.88 87.38 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 117.966 0.883 . . . . 0.0 113.042 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -65.77 -14.09 60.68 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -119.31 -14.1 9.24 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -66.86 -49.08 66.81 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.8 1.182 . . . . 0.0 111.255 161.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 81.0 p -63.01 -15.68 57.25 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.29 -11.84 60.08 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 171.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.98 -20.1 0.06 OUTLIER Glycine 0 CA--C 1.533 1.189 0 CA-C-O 117.677 -1.624 . . . . 0.0 116.626 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 76.08 18.69 1.94 Allowed 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 127.689 2.395 . . . . 0.0 113.788 -167.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.09 44.97 19.5 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.139 1.376 . . . . 0.0 112.525 -170.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.3 tpt85 -123.93 17.06 9.35 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.934 2.494 . . . . 0.0 111.454 -165.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.68 22.06 62.68 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.452 1.025 . . . . 0.0 114.226 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.5 p 42.45 79.97 0.3 Allowed Pre-proline 0 N--CA 1.481 1.098 0 C-N-CA 127.055 2.142 . . . . 0.0 113.592 -174.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -40.6 -44.93 4.58 Favored 'Trans proline' 0 C--N 1.355 0.872 1 C-N-CA 125.659 4.24 . . . . 0.0 117.865 -169.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.0 -8.49 23.25 Favored 'General case' 0 CA--C 1.551 1.005 0 N-CA-C 115.705 1.742 . . . . 0.0 115.705 177.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.5 m -134.0 11.19 3.93 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 127.002 2.121 . . . . 0.0 113.017 176.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -65.89 141.01 97.43 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.401 1.081 . . . . 0.0 110.484 176.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -50.26 -40.05 52.35 Favored 'Trans proline' 0 CA--C 1.549 1.242 0 C-N-CA 122.713 2.275 . . . . 0.0 116.138 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -58.61 -20.39 49.95 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 124.258 3.305 . . . . 0.0 116.174 171.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -104.06 -3.95 23.89 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.377 1.471 . . . . 0.0 112.802 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.14 38.77 3.47 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.09 2.156 . . . . 0.0 115.286 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.8 mp 58.67 18.32 5.8 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.475 1.91 . . . . 0.0 114.195 -177.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.347 0 O-C-N 119.372 -2.08 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 110.505 -0.183 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -66.96 -48.07 51.58 Favored Pre-proline 0 CA--C 1.554 1.098 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 175.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.88 -35.85 1.3 Allowed 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 121.865 1.71 . . . . 0.0 113.496 -178.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 45.81 35.15 2.13 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 127.16 2.184 . . . . 0.0 114.886 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.4 mt -74.29 -27.39 60.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 -175.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -147.86 -4.55 0.49 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.81 -33.23 70.13 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.112 -0.992 . . . . 0.0 113.501 -176.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.2 mtm180 -87.51 -65.07 1.05 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.732 0.813 . . . . 0.0 110.749 172.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -73.2 -49.85 25.74 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.96 1.304 . . . . 0.0 114.014 -168.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -80.47 -30.05 37.46 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.75 0.82 . . . . 0.0 111.259 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.28 -44.4 89.37 Favored Glycine 0 CA--C 1.535 1.328 0 C-N-CA 123.896 0.76 . . . . 0.0 113.068 167.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.68 -46.84 80.69 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.164 0.982 . . . . 0.0 112.753 174.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -65.23 -14.72 61.34 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -118.52 -15.55 9.59 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 114.517 1.302 . . . . 0.0 114.517 172.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.3 t-105 -65.26 -50.6 65.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.588 1.085 . . . . 0.0 111.091 161.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.4 p -62.28 -20.52 64.38 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.04 -12.28 59.46 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 173.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -143.61 -20.39 0.2 Allowed Glycine 0 CA--C 1.536 1.355 0 CA-C-O 117.942 -1.476 . . . . 0.0 115.818 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 65.18 21.26 12.1 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.971 1.709 . . . . 0.0 113.842 -168.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.48 42.33 14.31 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.442 1.497 . . . . 0.0 112.879 -171.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.1 tpt85 -122.73 15.93 10.22 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.355 2.262 . . . . 0.0 111.68 -168.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.6 26.51 42.33 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 124.4 1.0 . . . . 0.0 114.238 174.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.6 p 43.46 74.29 0.8 Allowed Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.702 2.001 . . . . 0.0 113.205 -176.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -41.36 -43.5 5.65 Favored 'Trans proline' 0 C--N 1.354 0.841 1 C-N-CA 125.453 4.102 . . . . 0.0 117.727 -169.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -9.54 22.25 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -133.2 5.65 3.82 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 126.577 1.951 . . . . 0.0 113.267 176.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -65.03 138.67 97.52 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.767 1.227 . . . . 0.0 110.608 174.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -47.61 -40.12 30.18 Favored 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 123.377 2.718 . . . . 0.0 117.653 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.02 -20.51 69.88 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.344 2.696 . . . . 0.0 115.23 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -99.02 -2.41 37.3 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.02 1.328 . . . . 0.0 112.707 172.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.71 37.66 3.54 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.08 2.152 . . . . 0.0 115.46 176.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp 58.34 19.34 6.27 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 126.422 1.889 . . . . 0.0 114.045 -177.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 O-C-N 119.489 -2.007 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 120.452 0.168 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.465 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 28.2 t70 -129.34 -47.28 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 125.334 1.454 . . . . 0.0 114.118 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 61.3 Cg_endo -73.35 -34.01 6.43 Favored 'Trans proline' 0 C--N 1.355 0.917 0 CA-C-N 122.037 1.763 . . . . 0.0 112.904 175.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 45.7 35.54 2.23 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 127.476 2.311 . . . . 0.0 115.014 173.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.71 -32.21 69.34 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -175.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -147.94 1.07 0.65 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.46 -34.19 68.74 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.046 -1.034 . . . . 0.0 113.246 -176.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -92.26 -65.09 1.03 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.832 0.853 . . . . 0.0 110.788 172.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -68.53 -49.41 59.78 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.783 1.233 . . . . 0.0 113.652 -168.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -83.36 -30.77 27.16 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.745 0.818 . . . . 0.0 111.365 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.46 -44.88 85.34 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.138 0.875 . . . . 0.0 113.011 169.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.36 -46.78 78.79 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.037 0.919 . . . . 0.0 112.83 174.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -64.71 -18.1 64.71 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 176.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -115.35 -13.14 11.68 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 173.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.4 t-105 -67.1 -53.23 32.77 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.451 1.023 . . . . 0.0 111.125 159.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.0 p -63.43 -18.82 64.13 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.76 -16.47 57.93 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.679 1.191 . . . . 0.0 114.126 171.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.98 -20.26 0.38 Allowed Glycine 0 CA--C 1.536 1.359 0 CA-C-O 118.15 -1.361 . . . . 0.0 115.335 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 70.68 20.74 5.58 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.66 1.984 . . . . 0.0 113.764 -166.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.76 42.99 16.54 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.392 1.477 . . . . 0.0 112.808 -172.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.8 tpt85 -120.61 8.8 10.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.77 2.428 . . . . 0.0 111.844 -166.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.52 21.95 59.27 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.581 1.086 . . . . 0.0 113.913 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.294 7.5 p 42.63 77.95 0.41 Allowed Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 127.121 2.168 . . . . 0.0 113.545 -177.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -39.87 -43.84 3.46 Favored 'Trans proline' 0 C--N 1.356 0.923 1 C-N-CA 125.954 4.436 . . . . 0.0 118.128 -166.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -9.4 20.99 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.715 1.746 . . . . 0.0 115.715 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.3 m -134.75 7.48 3.51 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.677 1.991 . . . . 0.0 113.118 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -63.13 138.87 97.45 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.83 1.252 . . . . 0.0 111.011 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.45 -40.91 29.46 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 123.427 2.751 . . . . 0.0 117.526 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -63.45 -22.32 71.24 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.237 2.625 . . . . 0.0 115.1 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -95.95 -10.86 27.61 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.734 1.214 . . . . 0.0 112.863 172.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.08 42.54 6.68 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.879 2.071 . . . . 0.0 115.018 177.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.1 mp 61.13 14.78 5.73 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.576 1.951 . . . . 0.0 114.376 -178.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.343 0 O-C-N 119.31 -2.119 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.1 mmt180 . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -68.74 -47.56 32.69 Favored Pre-proline 0 CA--C 1.553 1.08 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 173.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.76 -36.9 1.38 Allowed 'Trans proline' 0 C--N 1.357 1.008 0 CA-C-N 121.868 1.703 . . . . 0.0 113.299 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 44.68 35.6 1.48 Allowed 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 127.429 2.292 . . . . 0.0 115.149 176.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -70.72 -32.48 69.68 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -148.08 1.9 0.66 Allowed 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 178.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.51 -33.68 68.29 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.207 1.003 . . . . 0.0 113.293 -177.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.9 mtm180 -93.58 -63.84 1.16 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.836 0.854 . . . . 0.0 110.965 172.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -68.75 -50.69 48.48 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.453 1.101 . . . . 0.0 113.669 -169.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -81.43 -31.12 33.27 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.705 0.802 . . . . 0.0 111.386 177.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.45 -43.7 90.28 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 123.996 0.808 . . . . 0.0 113.239 169.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.75 -45.66 77.85 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.219 1.01 . . . . 0.0 112.782 174.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -65.29 -15.29 62.36 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -117.77 -13.3 10.16 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 65.5 t-105 -65.37 -52.27 54.73 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.574 1.079 . . . . 0.0 110.911 158.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.1 p -62.66 -20.34 64.72 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.87 -14.87 56.84 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.05 -22.7 0.44 Allowed Glycine 0 CA--C 1.535 1.285 0 CA-C-O 118.198 -1.335 . . . . 0.0 115.089 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 70.4 21.8 5.52 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.571 1.948 . . . . 0.0 113.935 -167.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.79 43.44 17.04 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.328 1.451 . . . . 0.0 112.708 -172.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -120.83 13.42 11.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.763 2.425 . . . . 0.0 111.501 -166.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.3 25.24 48.66 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.344 0.973 . . . . 0.0 114.015 177.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.276 7.4 p 44.25 76.47 0.53 Allowed Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.705 2.002 . . . . 0.0 113.326 -177.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -41.82 -43.49 6.73 Favored 'Trans proline' 0 C--N 1.354 0.816 1 C-N-CA 125.31 4.007 . . . . 0.0 117.501 -170.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -7.93 27.92 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 178.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.9 m -132.37 4.47 4.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.661 1.985 . . . . 0.0 113.31 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -65.18 138.65 97.34 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.986 1.314 . . . . 0.0 111.029 178.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -47.85 -41.01 32.46 Favored 'Trans proline' 0 CA--C 1.548 1.206 0 C-N-CA 123.488 2.792 . . . . 0.0 117.475 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.64 -20.8 71.9 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.342 2.695 . . . . 0.0 115.052 175.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -97.13 -3.15 41.64 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.918 1.287 . . . . 0.0 112.806 172.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 46.01 38.43 4.67 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.727 2.011 . . . . 0.0 115.028 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp 54.97 21.34 3.66 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.393 1.877 . . . . 0.0 115.022 -174.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 O-C-N 119.577 -1.952 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 110.811 -0.07 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -68.35 -48.06 36.1 Favored Pre-proline 0 CA--C 1.554 1.105 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 172.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -76.48 -42.2 0.38 Allowed 'Trans proline' 0 C--N 1.357 0.993 0 CA-C-N 121.924 1.723 . . . . 0.0 113.364 -178.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.74 33.93 1.07 Allowed 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 127.271 2.229 . . . . 0.0 114.907 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.4 mt -72.57 -31.02 64.91 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.985 -1.072 . . . . 0.0 113.601 -176.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -147.55 3.15 0.75 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.509 1.124 . . . . 0.0 113.891 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.83 -33.83 69.04 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.029 -1.044 . . . . 0.0 113.269 -176.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.9 mtm180 -91.63 -66.15 0.95 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.769 0.828 . . . . 0.0 110.813 172.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -67.23 -52.15 44.54 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.188 1.395 . . . . 0.0 113.792 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -80.94 -29.64 35.39 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.595 0.758 . . . . 0.0 111.48 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.9 -42.36 86.11 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.06 0.838 . . . . 0.0 113.209 168.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.37 68.63 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.014 0.907 . . . . 0.0 112.927 173.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.93 -18.88 64.67 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.863 1.265 . . . . 0.0 114.368 175.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -112.66 -14.91 13.09 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 172.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -65.55 -52.68 50.63 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 119.41 1.004 . . . . 0.0 111.14 161.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.2 p -63.19 -20.83 65.77 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.65 -16.05 62.21 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 173.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -136.69 -18.97 0.67 Allowed Glycine 0 CA--C 1.536 1.347 0 CA-C-O 118.327 -1.263 . . . . 0.0 115.064 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 79.62 18.64 0.72 Allowed 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 127.89 2.476 . . . . 0.0 113.659 -167.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.14 45.69 19.66 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.117 1.367 . . . . 0.0 112.355 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.9 tpt85 -122.07 14.36 10.62 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.788 2.435 . . . . 0.0 111.657 -163.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.65 21.6 71.66 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-O 118.701 -1.055 . . . . 0.0 113.734 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.287 6.7 p 42.01 81.58 0.24 Allowed Pre-proline 0 N--CA 1.48 1.04 0 C-N-CA 127.406 2.283 . . . . 0.0 113.688 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -41.27 -43.43 5.43 Favored 'Trans proline' 0 C--N 1.354 0.839 1 C-N-CA 125.623 4.215 . . . . 0.0 118.085 -166.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -7.74 22.61 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 178.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.5 m -127.95 -3.53 5.79 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.476 1.91 . . . . 0.0 113.4 175.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -62.2 137.28 95.79 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.18 1.392 . . . . 0.0 111.044 175.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.02 -39.64 33.07 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.481 2.787 . . . . 0.0 117.662 -178.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -61.61 -17.3 53.55 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.488 2.792 . . . . 0.0 115.516 174.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -107.25 2.27 24.53 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.395 1.478 . . . . 0.0 112.709 172.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 42.76 47.13 4.64 Favored 'General case' 0 CA--C 1.55 0.981 0 C-N-CA 127.353 2.261 . . . . 0.0 115.881 172.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 18.8 mt 57.92 18.76 5.25 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.808 1.643 . . . . 0.0 114.69 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 O-C-N 119.596 -1.94 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.56 0.219 . . . . 0.0 111.37 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.432 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 28.2 t70 -130.83 -47.9 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.983 0 C-N-CA 125.26 1.424 . . . . 0.0 114.138 -178.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.432 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 60.1 Cg_endo -73.2 -33.96 6.7 Favored 'Trans proline' 0 C--N 1.357 0.988 0 CA-C-N 122.211 1.825 . . . . 0.0 113.028 175.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.75 30.13 1.75 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.415 2.286 . . . . 0.0 115.355 175.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.15 -33.99 74.29 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.011 -1.056 . . . . 0.0 113.724 -175.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -149.04 2.17 0.57 Allowed 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.28 -36.37 68.53 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.415 1.086 . . . . 0.0 113.307 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.0 mtm180 -97.72 -62.89 1.18 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.141 0.976 . . . . 0.0 111.029 171.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -69.35 -40.86 77.25 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -168.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -91.3 -29.15 17.31 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.146 0.979 . . . . 0.0 111.418 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.52 -42.99 77.63 Favored Glycine 0 CA--C 1.538 1.483 0 C-N-CA 123.908 0.766 . . . . 0.0 112.946 167.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.23 -47.01 81.29 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 117.987 0.894 . . . . 0.0 113.083 174.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -65.57 -15.68 62.95 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.436 1.272 . . . . 0.0 114.436 176.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -115.8 -14.4 11.36 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 172.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -65.99 -51.95 53.83 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.529 1.059 . . . . 0.0 111.087 160.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.2 p -62.85 -19.0 63.7 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.83 -15.23 58.32 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.29 1.219 . . . . 0.0 114.29 172.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.04 -22.39 0.38 Allowed Glycine 0 CA--C 1.535 1.313 0 CA-C-O 118.291 -1.283 . . . . 0.0 115.211 177.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 74.24 20.06 2.74 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 127.104 2.162 . . . . 0.0 113.812 -167.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.77 44.17 17.6 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.173 1.389 . . . . 0.0 112.522 -171.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.6 tpt85 -121.68 12.83 10.72 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 127.724 2.41 . . . . 0.0 111.662 -165.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.46 22.82 57.88 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.576 1.084 . . . . 0.0 114.056 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.286 7.3 p 43.34 77.32 0.45 Allowed Pre-proline 0 N--CA 1.479 1.018 0 C-N-CA 126.866 2.067 . . . . 0.0 113.392 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -40.57 -43.57 4.29 Favored 'Trans proline' 0 C--N 1.355 0.881 1 C-N-CA 125.61 4.207 . . . . 0.0 117.985 -167.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -9.48 20.44 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.3 m -134.08 6.14 3.61 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.688 1.995 . . . . 0.0 113.26 176.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -64.09 139.43 97.68 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 124.747 1.219 . . . . 0.0 110.704 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.19 -40.55 27.36 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 123.456 2.771 . . . . 0.0 117.623 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -62.34 -21.74 73.09 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.35 2.7 . . . . 0.0 115.194 174.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -98.44 -7.4 28.67 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.939 1.296 . . . . 0.0 112.782 172.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.79 40.92 4.62 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.028 2.131 . . . . 0.0 115.321 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.5 mp 59.95 16.75 6.03 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 126.468 1.907 . . . . 0.0 114.225 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.308 0 O-C-N 119.358 -2.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 110.826 -0.064 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -74.01 -47.67 6.36 Favored Pre-proline 0 CA--C 1.553 1.091 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 174.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.66 -32.73 2.64 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 121.915 1.743 . . . . 0.0 113.526 -176.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.95 31.56 2.42 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 127.257 2.223 . . . . 0.0 115.583 174.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.35 -34.74 75.04 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -173.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -148.44 0.78 0.6 Allowed 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.98 -34.98 70.55 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.39 1.076 . . . . 0.0 113.504 -176.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -91.49 -63.47 1.25 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.991 0.917 . . . . 0.0 111.013 172.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -73.25 -46.81 47.85 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.946 1.298 . . . . 0.0 114.044 -168.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -82.05 -27.64 32.9 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.597 0.759 . . . . 0.0 111.243 175.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.23 -43.31 84.09 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 123.977 0.799 . . . . 0.0 113.172 166.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.75 -44.98 80.04 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.142 0.971 . . . . 0.0 113.103 174.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -63.95 -15.36 59.01 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.036 1.334 . . . . 0.0 114.494 176.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -117.87 -10.84 10.37 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 172.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -68.0 -51.45 47.04 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.649 1.113 . . . . 0.0 111.065 158.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.8 p -63.18 -16.13 59.13 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.99 -13.73 58.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 171.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.14 -22.1 0.07 OUTLIER Glycine 0 CA--C 1.535 1.287 0 CA-C-O 117.929 -1.484 . . . . 0.0 116.122 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 69.21 20.65 7.46 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 126.765 2.026 . . . . 0.0 113.794 -166.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.47 42.85 15.08 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.32 1.448 . . . . 0.0 112.785 -171.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.8 tpt85 -116.79 12.73 14.91 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.626 2.371 . . . . 0.0 111.732 -167.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.87 20.91 60.34 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 124.588 1.09 . . . . 0.0 113.937 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.4 p 41.61 77.89 0.41 Allowed Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 126.989 2.115 . . . . 0.0 113.245 -175.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -41.17 -41.26 4.52 Favored 'Trans proline' 0 C--N 1.354 0.863 1 C-N-CA 125.883 4.389 . . . . 0.0 118.496 -165.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -9.61 18.64 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 176.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 65.3 m -133.57 14.05 4.08 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.108 2.163 . . . . 0.0 112.917 177.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.58 140.35 96.45 Favored Pre-proline 0 CA--C 1.551 1.015 0 O-C-N 120.896 -1.128 . . . . 0.0 111.224 177.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -51.82 -39.97 66.89 Favored 'Trans proline' 0 CA--C 1.549 1.227 0 C-N-CA 122.941 2.427 . . . . 0.0 116.193 174.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -60.36 -21.63 68.04 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.484 2.79 . . . . 0.0 115.618 172.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -95.72 0.76 52.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.885 1.274 . . . . 0.0 112.629 171.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 47.03 33.95 2.56 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.909 2.084 . . . . 0.0 114.803 -177.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.3 mp 56.48 21.36 5.54 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.477 1.911 . . . . 0.0 114.008 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 O-C-N 119.481 -2.012 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 110.727 -0.101 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -70.57 -49.39 15.72 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 173.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -79.8 -34.89 0.84 Allowed 'Trans proline' 0 C--N 1.357 0.976 0 CA-C-N 121.874 1.705 . . . . 0.0 113.684 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 43.32 37.95 1.52 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 127.295 2.238 . . . . 0.0 113.982 -176.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.6 -39.3 77.35 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.494 1.118 . . . . 0.0 112.562 -171.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -143.99 2.67 1.19 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.812 1.245 . . . . 0.0 113.534 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.58 -32.85 69.33 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 120.969 -1.082 . . . . 0.0 113.414 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 -88.29 -66.75 0.88 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.789 0.836 . . . . 0.0 110.756 172.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -69.64 -53.7 17.46 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.223 1.409 . . . . 0.0 113.801 -169.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -77.44 -31.14 53.68 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.645 0.778 . . . . 0.0 111.427 177.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -57.2 -42.76 93.52 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.141 0.877 . . . . 0.0 113.364 169.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.78 -46.9 73.82 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.183 0.992 . . . . 0.0 112.776 173.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -64.52 -17.52 63.98 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 175.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -113.54 -13.31 12.79 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 172.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.8 t-105 -67.49 -51.8 46.85 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.475 1.034 . . . . 0.0 111.192 160.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.6 p -63.51 -17.9 63.25 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.422 1.268 . . . . 0.0 114.422 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.85 -16.17 57.45 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.681 1.192 . . . . 0.0 114.192 171.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -136.71 -24.17 0.48 Allowed Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.862 1.22 . . . . 0.0 114.85 175.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 73.0 18.66 3.89 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.986 2.114 . . . . 0.0 113.823 -165.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.63 43.66 16.6 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.242 1.417 . . . . 0.0 112.581 -170.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -117.57 10.47 13.48 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 127.502 2.321 . . . . 0.0 112.086 -165.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.96 21.52 65.52 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 118.805 -0.997 . . . . 0.0 113.676 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.288 7.2 p 40.16 78.54 0.36 Allowed Pre-proline 0 N--CA 1.48 1.05 0 C-N-CA 127.3 2.24 . . . . 0.0 113.513 -177.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -40.1 -41.86 3.24 Favored 'Trans proline' 0 C--N 1.355 0.897 1 C-N-CA 126.091 4.527 . . . . 0.0 118.71 -164.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -9.33 12.55 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 177.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.9 m -129.32 9.17 5.59 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.517 1.927 . . . . 0.0 113.004 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -70.49 140.04 87.03 Favored Pre-proline 0 CA--C 1.551 0.992 0 O-C-N 120.94 -1.1 . . . . 0.0 111.301 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -51.3 -39.79 62.32 Favored 'Trans proline' 0 CA--C 1.548 1.207 0 C-N-CA 123.177 2.585 . . . . 0.0 116.511 175.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -60.07 -20.38 60.68 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.548 2.832 . . . . 0.0 115.709 172.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.16 2.16 42.73 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.045 1.338 . . . . 0.0 112.575 172.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 46.29 37.06 3.74 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.721 2.009 . . . . 0.0 114.653 -178.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.2 mp 57.81 20.64 6.72 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.413 1.885 . . . . 0.0 114.104 -176.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 O-C-N 119.33 -2.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 120.44 0.162 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.407 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.7 t70 -113.23 -48.15 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.085 1.354 . . . . 0.0 113.65 176.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.407 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 69.7 Cg_endo -75.7 -36.39 2.18 Favored 'Trans proline' 0 C--N 1.357 0.98 0 CA-C-N 122.049 1.767 . . . . 0.0 113.112 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 43.01 37.97 1.29 Allowed 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 127.544 2.337 . . . . 0.0 114.713 178.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 98.2 mt -70.91 -32.45 69.38 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -148.63 3.29 0.64 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.35 -34.15 68.51 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.025 -1.047 . . . . 0.0 113.195 -176.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 -91.99 -65.01 1.04 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.782 0.833 . . . . 0.0 111.033 171.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -68.69 -48.06 64.86 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.875 1.27 . . . . 0.0 114.153 -169.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -83.77 -29.53 27.35 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.803 0.841 . . . . 0.0 111.408 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.57 -41.93 89.72 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 123.999 0.809 . . . . 0.0 113.172 168.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.58 -45.68 78.46 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.142 0.971 . . . . 0.0 112.834 173.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.62 -17.28 63.87 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 175.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -114.17 -11.55 12.64 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 172.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -68.4 -53.49 23.47 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.48 1.036 . . . . 0.0 110.995 158.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.9 p -63.63 -17.62 63.09 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.37 -16.37 54.18 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.325 1.232 . . . . 0.0 114.325 171.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.87 -18.78 0.18 Allowed Glycine 0 CA--C 1.535 1.288 0 CA-C-O 118.034 -1.426 . . . . 0.0 115.671 178.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 81.06 18.43 0.48 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 128.185 2.594 . . . . 0.0 113.575 -167.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.26 45.12 20.14 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.98 1.312 . . . . 0.0 112.44 -170.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -121.85 12.81 10.59 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 127.938 2.495 . . . . 0.0 111.736 -164.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.6 20.53 68.56 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.519 1.057 . . . . 0.0 114.003 -178.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.292 7.6 p 43.35 80.1 0.3 Allowed Pre-proline 0 N--CA 1.48 1.031 0 C-N-CA 127.167 2.187 . . . . 0.0 113.499 -176.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -41.04 -43.74 4.96 Favored 'Trans proline' 0 C--N 1.355 0.898 1 C-N-CA 125.721 4.281 . . . . 0.0 117.882 -167.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -7.48 20.25 Favored 'General case' 0 CA--C 1.551 1.018 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 178.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.1 m -130.73 -3.24 4.16 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.475 1.91 . . . . 0.0 113.513 175.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.17 138.77 91.48 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 125.69 1.596 . . . . 0.0 111.498 178.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -46.93 -38.93 24.31 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 123.598 2.865 . . . . 0.0 117.997 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -63.17 -20.66 71.47 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.365 2.71 . . . . 0.0 115.171 173.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -103.44 -13.29 16.68 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.147 1.379 . . . . 0.0 112.888 172.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.37 51.43 7.68 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 127.103 2.161 . . . . 0.0 115.039 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 32.9 mt 61.15 12.62 4.18 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 126.36 1.864 . . . . 0.0 114.899 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 O-C-N 119.538 -1.977 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 120.896 0.379 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.417 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.9 t70 -131.89 -48.43 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.309 1.444 . . . . 0.0 113.93 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.417 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 57.1 Cg_endo -72.95 -38.47 2.89 Favored 'Trans proline' 0 C--N 1.356 0.923 0 CA-C-N 122.137 1.799 . . . . 0.0 112.801 174.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.58 36.22 2.46 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 127.309 2.244 . . . . 0.0 114.645 176.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.9 mt -76.4 -24.35 54.05 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -176.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -147.36 -1.62 0.62 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.28 -33.36 69.34 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.028 -1.045 . . . . 0.0 113.413 -177.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -92.27 -65.01 1.04 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.912 0.885 . . . . 0.0 110.975 171.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -71.38 -34.57 70.54 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -168.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -99.27 -27.36 13.82 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.474 1.109 . . . . 0.0 111.337 176.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.4 -40.02 75.32 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.753 0.692 . . . . 0.0 112.894 164.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.53 -46.19 87.17 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.083 0.941 . . . . 0.0 112.933 172.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -65.69 -11.62 46.7 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.966 1.306 . . . . 0.0 114.334 174.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -120.63 -11.72 9.01 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 70.8 t-105 -65.3 -50.17 66.71 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.664 1.12 . . . . 0.0 110.91 159.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.5 p -62.03 -16.63 53.23 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.19 -13.9 61.01 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 171.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.06 -16.53 0.1 OUTLIER Glycine 0 CA--C 1.536 1.394 0 CA-C-O 117.874 -1.514 . . . . 0.0 116.14 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 75.01 18.62 2.5 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 127.323 2.249 . . . . 0.0 113.958 -166.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.78 45.21 18.37 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.392 1.477 . . . . 0.0 112.385 -171.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 tpt85 -124.93 15.06 8.56 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 127.963 2.505 . . . . 0.0 111.638 -163.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.3 16.83 68.13 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.724 1.154 . . . . 0.0 114.195 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.303 6.8 p 44.81 80.08 0.31 Allowed Pre-proline 0 N--CA 1.479 1.013 0 C-N-CA 127.07 2.148 . . . . 0.0 113.124 -173.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -41.72 -43.39 6.49 Favored 'Trans proline' 0 C--N 1.356 0.921 1 C-N-CA 125.553 4.169 . . . . 0.0 118.125 -169.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -6.56 20.73 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 177.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.4 m -133.06 12.58 4.28 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.968 2.107 . . . . 0.0 112.956 176.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -68.66 141.1 92.47 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.829 1.251 . . . . 0.0 111.1 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -52.84 -40.37 75.13 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 123.237 2.625 . . . . 0.0 115.222 172.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -56.85 -19.21 30.57 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.937 3.091 . . . . 0.0 116.463 169.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -106.47 2.83 26.63 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.155 1.382 . . . . 0.0 112.829 173.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.64 47.19 8.62 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.775 2.03 . . . . 0.0 114.676 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.9 mt 62.3 14.04 6.45 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 126.462 1.905 . . . . 0.0 114.894 -177.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.347 0 O-C-N 119.49 -2.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.547 0.213 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -129.56 -48.95 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.201 1.4 . . . . 0.0 113.733 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -73.4 -38.71 2.42 Favored 'Trans proline' 0 C--N 1.357 1.011 0 CA-C-N 122.034 1.762 . . . . 0.0 112.745 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.72 34.69 1.87 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 127.294 2.238 . . . . 0.0 114.669 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.4 mt -76.25 -26.22 55.77 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -147.49 0.62 0.69 Allowed 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 -177.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.24 -37.21 69.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.364 1.065 . . . . 0.0 113.212 -177.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -95.3 -62.82 1.24 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.759 0.824 . . . . 0.0 111.095 169.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -71.23 -30.35 66.24 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 -167.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -102.81 -28.8 11.85 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.799 1.24 . . . . 0.0 111.333 174.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.3 -41.97 81.21 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.741 0.686 . . . . 0.0 112.948 166.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.55 -44.95 96.12 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.06 0.93 . . . . 0.0 113.021 174.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -66.64 -13.5 61.25 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 176.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -117.77 -13.69 10.15 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 171.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -66.71 -50.03 64.13 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.668 1.122 . . . . 0.0 110.924 159.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.5 p -63.93 -13.74 48.09 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.3 -12.14 59.36 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 170.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.97 -23.89 0.06 OUTLIER Glycine 0 CA--C 1.535 1.302 0 CA-C-O 117.786 -1.563 . . . . 0.0 116.16 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 67.68 22.03 9.12 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.396 1.879 . . . . 0.0 113.718 -167.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.18 42.01 16.68 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.437 1.495 . . . . 0.0 113.043 -172.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.2 tpt85 -120.29 8.49 10.86 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.509 2.324 . . . . 0.0 112.102 -168.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.6 20.83 53.24 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.774 1.178 . . . . 0.0 114.212 176.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.296 7.2 p 43.5 77.68 0.43 Allowed Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 126.82 2.048 . . . . 0.0 113.441 -174.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -41.18 -42.82 5.1 Favored 'Trans proline' 0 C--N 1.355 0.91 1 C-N-CA 125.724 4.283 . . . . 0.0 118.051 -168.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -9.48 24.28 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 177.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.9 m -134.09 11.96 3.91 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.659 1.984 . . . . 0.0 112.91 176.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -64.37 140.82 98.05 Favored Pre-proline 0 CA--C 1.548 0.881 0 O-C-N 120.885 -1.134 . . . . 0.0 111.089 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -53.15 -41.51 71.57 Favored 'Trans proline' 0 CA--C 1.55 1.322 0 C-N-CA 122.424 2.083 . . . . 0.0 115.482 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -54.83 -22.22 28.91 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 124.222 3.281 . . . . 0.0 116.764 169.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -100.19 -6.17 26.53 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.572 1.149 . . . . 0.0 113.114 173.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.87 45.48 8.51 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.359 1.864 . . . . 0.0 114.595 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.2 mt 64.05 11.08 5.88 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 126.859 2.063 . . . . 0.0 115.16 -177.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.395 0 O-C-N 119.523 -1.986 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 120.625 0.25 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -135.45 -49.86 0.02 OUTLIER Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.086 1.355 . . . . 0.0 113.684 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -73.58 -34.2 5.91 Favored 'Trans proline' 0 C--N 1.358 1.034 0 CA-C-N 121.975 1.741 . . . . 0.0 113.035 174.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 43.54 38.35 1.83 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 127.508 2.323 . . . . 0.0 114.195 178.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.85 -30.67 62.8 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.272 1.029 . . . . 0.0 113.23 -173.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -145.54 -0.77 0.83 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.92 -33.54 68.9 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.029 -1.045 . . . . 0.0 113.365 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.7 mtm180 -89.43 -63.78 1.24 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.563 0.745 . . . . 0.0 110.902 170.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -72.08 -43.84 64.21 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.267 1.427 . . . . 0.0 114.568 -169.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -88.22 -27.05 22.05 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.998 0.919 . . . . 0.0 111.48 175.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.24 -43.0 89.31 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 123.612 0.625 . . . . 0.0 112.76 165.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.17 -44.21 92.77 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.048 0.924 . . . . 0.0 112.988 173.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.97 -15.52 62.32 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -119.7 -15.43 8.93 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 172.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -67.05 -50.38 62.1 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.387 0.994 . . . . 0.0 111.125 162.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.1 p -63.32 -19.59 64.74 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.9 -14.14 58.85 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 172.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -140.32 -20.23 0.36 Allowed Glycine 0 CA--C 1.535 1.318 0 CA-C-O 118.008 -1.44 . . . . 0.0 115.377 178.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 76.41 21.99 1.32 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 127.355 2.262 . . . . 0.0 113.675 -167.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.34 43.52 19.34 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.152 1.381 . . . . 0.0 112.649 -172.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -122.54 9.61 9.65 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.84 2.456 . . . . 0.0 111.887 -164.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.44 21.76 53.22 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.592 1.091 . . . . 0.0 114.233 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.294 7.1 p 43.83 76.01 0.58 Allowed Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 126.804 2.042 . . . . 0.0 113.235 -176.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -40.72 -43.21 4.42 Favored 'Trans proline' 0 C--N 1.355 0.877 1 C-N-CA 125.763 4.309 . . . . 0.0 117.974 -167.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -9.87 18.61 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.0 m -131.81 3.29 4.11 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.3 1.84 . . . . 0.0 113.464 175.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -64.95 138.87 97.62 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 124.95 1.3 . . . . 0.0 111.17 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -47.63 -40.36 30.51 Favored 'Trans proline' 0 CA--C 1.548 1.213 0 C-N-CA 123.651 2.901 . . . . 0.0 117.705 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -61.65 -20.61 69.51 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.411 2.74 . . . . 0.0 115.202 174.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -99.52 -2.53 35.62 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.925 1.29 . . . . 0.0 112.776 172.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.81 38.69 4.55 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.755 2.022 . . . . 0.0 115.137 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.0 mp 58.12 18.98 5.66 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.337 1.855 . . . . 0.0 114.484 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 O-C-N 119.398 -2.063 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 120.6 0.238 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.421 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.0 t70 -128.41 -48.51 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.235 1.414 . . . . 0.0 113.816 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.421 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.7 Cg_endo -73.49 -38.84 2.29 Favored 'Trans proline' 0 C--N 1.356 0.921 0 CA-C-N 122.086 1.781 . . . . 0.0 112.71 174.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.43 34.92 1.71 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 127.315 2.246 . . . . 0.0 114.728 177.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.5 mt -75.56 -26.15 57.71 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.04 -1.037 . . . . 0.0 113.704 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -147.89 -0.93 0.6 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -178.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.86 -34.77 70.1 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.096 -1.002 . . . . 0.0 113.325 -176.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.2 mtm180 -91.11 -65.51 1.01 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.69 0.796 . . . . 0.0 110.834 170.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -69.82 -40.03 76.13 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.238 1.415 . . . . 0.0 114.538 -168.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -93.63 -29.59 15.38 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.393 1.077 . . . . 0.0 111.249 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.46 -41.33 80.47 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 123.876 0.75 . . . . 0.0 113.184 168.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.14 -48.11 79.85 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 118.072 0.936 . . . . 0.0 112.807 173.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -64.32 -13.85 52.56 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -121.75 -19.0 6.94 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 171.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -62.0 -47.58 84.15 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.624 1.102 . . . . 0.0 111.308 164.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.0 p -61.97 -24.96 67.33 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.14 -5.91 42.25 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -132.7 -26.81 0.62 Allowed Glycine 0 CA--C 1.535 1.333 0 C-N-CA 124.941 1.258 . . . . 0.0 114.558 177.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 63.44 25.81 14.66 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.396 1.478 . . . . 0.0 113.802 -169.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.44 40.72 15.48 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.667 1.587 . . . . 0.0 113.339 -173.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -113.12 11.96 18.99 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 127.167 2.187 . . . . 0.0 111.969 -171.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.96 26.02 35.85 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 118.911 -0.938 . . . . 0.0 113.921 175.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.283 8.8 p 43.63 72.95 1.04 Allowed Pre-proline 0 N--CA 1.48 1.028 0 C-N-CA 126.644 1.978 . . . . 0.0 113.359 -177.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -41.54 -41.81 5.62 Favored 'Trans proline' 0 C--N 1.355 0.881 1 C-N-CA 125.64 4.227 . . . . 0.0 117.9 -168.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -10.1 21.62 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 115.666 1.728 . . . . 0.0 115.666 177.629 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.9 m -133.36 3.26 3.61 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.222 1.809 . . . . 0.0 113.666 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -61.86 138.75 95.57 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.02 1.328 . . . . 0.0 111.148 176.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -47.01 -40.86 26.22 Favored 'Trans proline' 0 CA--C 1.548 1.217 0 C-N-CA 123.64 2.893 . . . . 0.0 117.79 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.47 -21.14 72.39 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.24 2.626 . . . . 0.0 115.043 175.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -97.29 -6.63 33.98 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.859 1.263 . . . . 0.0 112.81 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.34 40.26 5.15 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 126.964 2.105 . . . . 0.0 115.104 177.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.1 mp 55.5 19.54 3.24 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 126.564 1.945 . . . . 0.0 115.007 -175.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 O-C-N 119.395 -2.066 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 120.588 0.233 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -132.19 -49.09 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.993 0 CA-C-O 117.208 -1.377 . . . . 0.0 113.845 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -73.18 -38.25 2.86 Favored 'Trans proline' 0 C--N 1.357 0.997 0 CA-C-N 122.14 1.8 . . . . 0.0 112.729 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.45 33.31 1.89 Allowed 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 127.244 2.218 . . . . 0.0 114.799 175.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.3 mt -73.69 -28.2 61.62 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.074 -1.016 . . . . 0.0 113.563 -176.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -148.06 2.08 0.67 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.52 -36.21 68.93 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 121.118 -0.988 . . . . 0.0 113.182 -177.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 -91.89 -65.28 1.02 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.557 0.743 . . . . 0.0 110.86 170.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -66.77 -46.06 76.53 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.862 1.265 . . . . 0.0 114.205 -169.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -88.72 -30.16 19.29 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.128 0.971 . . . . 0.0 111.407 177.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.33 -42.67 89.26 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 123.889 0.757 . . . . 0.0 113.17 170.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.64 -46.27 83.22 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.074 0.937 . . . . 0.0 112.833 173.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -65.01 -16.61 63.64 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 176.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -116.27 -13.41 11.08 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 172.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -67.46 -52.01 44.48 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.489 1.041 . . . . 0.0 111.021 160.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.2 p -62.56 -19.22 63.46 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.45 -13.82 53.64 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 171.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -143.55 -21.46 0.19 Allowed Glycine 0 CA--C 1.535 1.289 0 CA-C-O 117.836 -1.536 . . . . 0.0 115.722 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 70.02 20.7 6.42 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.427 1.891 . . . . 0.0 113.524 -165.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.82 37.02 6.54 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.571 1.549 . . . . 0.0 113.106 -171.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 48.5 tpt85 -102.71 -13.62 17.0 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.514 2.326 . . . . 0.0 113.059 -169.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.74 21.29 8.75 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.947 1.261 . . . . 0.0 113.759 -175.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.299 7.7 p 44.86 80.23 0.3 Allowed Pre-proline 0 N--CA 1.48 1.055 0 C-N-CA 127.345 2.258 . . . . 0.0 113.783 -177.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -42.66 -42.33 8.5 Favored 'Trans proline' 0 C--N 1.354 0.862 1 C-N-CA 125.57 4.18 . . . . 0.0 117.961 -170.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -5.94 18.71 Favored 'General case' 0 CA--C 1.551 1.018 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.4 m -134.33 12.26 3.84 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 127.221 2.208 . . . . 0.0 112.713 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -65.26 143.59 98.82 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 125.066 1.346 . . . . 0.0 111.931 -177.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.57 -39.6 74.75 Favored 'Trans proline' 0 CA--C 1.548 1.212 0 C-N-CA 123.041 2.494 . . . . 0.0 116.214 173.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -60.02 -20.54 61.14 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.668 2.912 . . . . 0.0 115.602 170.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -99.02 6.67 46.54 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.449 1.5 . . . . 0.0 112.321 171.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 48.46 32.63 3.44 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 127.202 2.201 . . . . 0.0 115.123 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.14 28.65 9.25 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 125.587 1.555 . . . . 0.0 113.597 -174.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.349 0 O-C-N 119.326 -2.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -68.13 -49.63 33.95 Favored Pre-proline 0 CA--C 1.554 1.108 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 175.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.48 -42.97 0.19 Allowed 'Trans proline' 0 C--N 1.356 0.948 0 CA-C-N 121.845 1.695 . . . . 0.0 113.461 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.2 32.86 1.58 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 126.968 2.107 . . . . 0.0 114.396 -176.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.6 mt -79.01 -22.51 45.38 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -177.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -146.57 -1.89 0.68 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.18 -35.21 69.31 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.338 1.055 . . . . 0.0 113.297 -177.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.7 mtm180 -96.18 -65.75 0.95 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.936 0.894 . . . . 0.0 110.969 169.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -68.89 -19.26 64.22 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -167.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -120.9 -33.56 3.73 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.677 1.591 . . . . 0.0 111.297 176.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.64 -41.26 97.3 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.077 0.846 . . . . 0.0 113.813 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.94 -40.22 79.12 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 118.488 1.144 . . . . 0.0 112.682 174.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -64.64 -17.9 64.45 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.212 1.405 . . . . 0.0 114.617 176.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -111.27 -14.97 13.73 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 173.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 70.9 t-105 -67.56 -52.43 38.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.571 1.078 . . . . 0.0 110.906 160.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.3 p -63.32 -19.15 64.35 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.1 -16.92 61.57 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 171.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -134.41 -21.03 0.77 Allowed Glycine 0 CA--C 1.535 1.338 0 CA-C-O 118.209 -1.329 . . . . 0.0 114.895 176.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 74.96 19.16 2.43 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.094 2.157 . . . . 0.0 113.625 -167.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.92 43.38 17.54 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.211 1.405 . . . . 0.0 112.569 -170.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -121.03 8.22 10.4 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.593 2.357 . . . . 0.0 112.11 -165.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.44 21.44 58.36 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.567 1.08 . . . . 0.0 114.044 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.293 7.1 p 40.47 77.95 0.4 Allowed Pre-proline 0 N--CA 1.481 1.105 0 C-N-CA 127.086 2.154 . . . . 0.0 113.411 -177.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -40.05 -42.26 3.29 Favored 'Trans proline' 0 C--N 1.356 0.949 1 C-N-CA 126.032 4.488 . . . . 0.0 118.481 -163.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -8.88 7.95 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.71 1.745 . . . . 0.0 115.71 177.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.5 m -127.46 7.57 6.39 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.298 1.839 . . . . 0.0 113.107 176.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -74.15 142.12 78.56 Favored Pre-proline 0 CA--C 1.554 1.116 0 O-C-N 120.909 -1.12 . . . . 0.0 111.477 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -51.58 -38.42 65.08 Favored 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 123.35 2.7 . . . . 0.0 116.992 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -60.06 -20.4 60.68 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.609 2.873 . . . . 0.0 115.447 171.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -102.29 10.0 39.51 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.437 1.495 . . . . 0.0 112.059 171.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 48.47 33.46 4.01 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.129 2.172 . . . . 0.0 115.068 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 54.65 29.52 11.7 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.512 1.525 . . . . 0.0 113.503 -175.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 O-C-N 119.344 -2.098 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 120.488 0.185 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.542 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.5 t70 -129.03 -48.44 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 125.312 1.445 . . . . 0.0 113.995 178.115 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.542 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 72.9 Cg_endo -74.77 -30.02 8.04 Favored 'Trans proline' 0 C--N 1.356 0.935 0 CA-C-N 121.984 1.744 . . . . 0.0 112.99 174.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 43.21 43.56 4.04 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.727 2.411 . . . . 0.0 114.717 171.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.4 mt -68.82 -37.12 78.98 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -174.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -149.3 3.62 0.59 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.553 1.141 . . . . 0.0 114.054 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.507 0 O-C-N 120.958 -1.089 . . . . 0.0 113.507 -176.537 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.3 mtm180 . . . . . 0 N--CA 1.473 0.686 0 CA-C-O 120.537 0.208 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -72.04 -33.69 68.2 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -167.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -97.29 -29.86 13.3 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.301 1.041 . . . . 0.0 111.086 175.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -57.28 -41.76 93.15 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.104 0.859 . . . . 0.0 113.359 169.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.675 0 CA-C-N 118.013 0.906 . . . . 0.0 112.816 172.704 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 . . . . . 0 CA--C 1.548 0.868 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -113.48 -11.83 13.02 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 173.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -67.15 -53.82 27.04 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.369 0.986 . . . . 0.0 110.918 158.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.9 p -63.54 -18.76 64.19 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.54 -16.53 56.52 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 171.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.242 0 CA-C-O 118.255 -1.303 . . . . 0.0 115.134 178.246 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 . . . . . 0 N--CA 1.48 1.044 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.69 41.05 13.15 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.591 1.556 . . . . 0.0 112.89 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.4 tpt85 -112.92 6.68 17.96 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 127.609 2.364 . . . . 0.0 112.142 -169.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.13 22.23 59.5 Favored Glycine 0 CA--C 1.532 1.146 0 CA-C-O 118.687 -1.063 . . . . 0.0 113.761 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.288 7.1 p 40.4 77.98 0.39 Allowed Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 127.308 2.243 . . . . 0.0 113.441 -177.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -39.09 -44.54 2.62 Favored 'Trans proline' 0 C--N 1.355 0.895 1 C-N-CA 126.101 4.534 . . . . 0.0 118.417 -164.115 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.618 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -62.26 -9.9 9.29 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 178.059 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.7 m -129.9 7.59 5.17 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.512 1.925 . . . . 0.0 113.044 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -71.41 140.06 84.6 Favored Pre-proline 0 CA--C 1.554 1.104 0 O-C-N 121.023 -1.048 . . . . 0.0 110.523 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -48.24 -39.29 34.63 Favored 'Trans proline' 0 CA--C 1.549 1.23 0 C-N-CA 123.492 2.795 . . . . 0.0 117.66 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -61.22 -18.63 59.68 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 123.481 2.787 . . . . 0.0 115.419 173.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -104.23 4.39 33.8 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.517 1.527 . . . . 0.0 112.532 172.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.52 46.7 8.22 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.2 2.2 . . . . 0.0 115.56 173.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.6 mt . . . . . 0 N--CA 1.479 1.004 0 C-N-CA 126.258 1.823 . . . . 0.0 114.731 -179.126 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 120.607 0.242 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.546 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.0 t70 -133.65 -49.05 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.169 1.388 . . . . 0.0 113.796 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.546 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 60.2 Cg_endo -73.03 -33.86 7.05 Favored 'Trans proline' 0 C--N 1.357 0.977 0 CA-C-N 122.06 1.771 . . . . 0.0 112.918 174.524 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.48 39.53 3.26 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 127.566 2.346 . . . . 0.0 114.873 172.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.5 mt -72.32 -31.74 65.93 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -175.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -148.38 2.93 0.66 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.651 0 O-C-N 120.99 -1.069 . . . . 0.0 113.42 -177.289 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.0 mtm180 . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.3 0.095 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -72.83 -19.03 61.4 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 -167.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -117.3 -28.37 6.17 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.493 1.517 . . . . 0.0 111.339 176.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.88 -41.04 91.23 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.042 0.829 . . . . 0.0 113.22 167.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.644 0 CA-C-N 118.054 0.927 . . . . 0.0 112.811 172.039 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.1 t70 . . . . . 0 CA--C 1.547 0.848 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -113.27 -13.87 12.9 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 172.255 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -66.76 -53.37 33.78 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.46 1.027 . . . . 0.0 111.001 160.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.1 p -62.56 -18.65 62.5 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.02 -14.63 60.9 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 171.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.294 0 CA-C-O 118.021 -1.433 . . . . 0.0 115.975 179.792 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.31 43.98 15.61 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 125.375 1.47 . . . . 0.0 112.674 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.1 tpt85 -121.86 19.02 11.01 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.651 2.38 . . . . 0.0 111.341 -166.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.14 23.15 61.79 Favored Glycine 0 CA--C 1.532 1.141 0 CA-C-O 118.854 -0.97 . . . . 0.0 113.969 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.289 7.1 p 42.67 75.99 0.57 Allowed Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 127.043 2.137 . . . . 0.0 113.384 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -40.61 -44.33 4.48 Favored 'Trans proline' 0 C--N 1.354 0.841 1 C-N-CA 125.643 4.229 . . . . 0.0 117.941 -167.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.584 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.99 -8.99 13.23 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 178.171 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.5 m -133.28 5.85 3.81 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.799 2.04 . . . . 0.0 113.217 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -66.88 138.97 95.43 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.577 1.151 . . . . 0.0 110.435 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -47.95 -40.1 32.73 Favored 'Trans proline' 0 CA--C 1.548 1.214 0 C-N-CA 123.278 2.652 . . . . 0.0 117.812 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -61.33 -19.47 64.19 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.36 2.707 . . . . 0.0 115.446 174.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -102.01 -1.7 31.23 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.119 1.368 . . . . 0.0 112.757 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.44 39.11 4.25 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.097 2.159 . . . . 0.0 115.595 175.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 CA--C 1.554 1.098 0 C-N-CA 126.327 1.851 . . . . 0.0 114.097 -177.97 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 120.435 0.16 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.474 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.8 t70 -114.04 -47.88 0.05 OUTLIER Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 125.135 1.374 . . . . 0.0 113.805 176.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.474 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 59.6 Cg_endo -74.16 -39.69 1.55 Allowed 'Trans proline' 0 C--N 1.357 1.02 0 CA-C-N 122.05 1.768 . . . . 0.0 112.957 176.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.87 35.22 1.42 Allowed 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 127.301 2.241 . . . . 0.0 114.822 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.35 -29.58 62.75 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.009 -1.057 . . . . 0.0 113.772 -175.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -146.72 0.38 0.76 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.564 1.146 . . . . 0.0 113.789 178.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.665 0 C-N-CA 124.309 1.044 . . . . 0.0 113.203 -177.267 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 . . . . . 0 N--CA 1.472 0.649 0 CA-C-O 120.346 0.117 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -73.67 -47.49 39.42 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.715 1.206 . . . . 0.0 114.024 -168.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -81.69 -29.66 32.94 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.564 0.746 . . . . 0.0 111.283 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.23 -44.68 89.08 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.058 0.837 . . . . 0.0 112.792 167.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.555 0 CA-C-N 118.031 0.915 . . . . 0.0 112.623 173.542 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.9 t70 . . . . . 0 CA--C 1.547 0.851 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -115.87 -15.38 11.26 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 172.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 71.8 t-105 -66.44 -51.65 54.63 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.312 0.96 . . . . 0.0 111.179 162.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 82.8 p -62.87 -19.48 64.2 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.59 -13.72 59.63 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 172.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.308 0 CA-C-O 117.724 -1.598 . . . . 0.0 116.11 -179.616 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 . . . . . 0 N--CA 1.479 1.018 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.97 31.92 2.61 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 125.968 1.707 . . . . 0.0 113.709 -170.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -93.78 -8.83 39.48 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.786 2.035 . . . . 0.0 113.084 -174.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.46 26.52 6.49 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.51 1.052 . . . . 0.0 113.325 -176.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.295 8.2 p 44.39 74.19 0.83 Allowed Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 127.45 2.3 . . . . 0.0 113.604 -177.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -41.91 -42.03 6.6 Favored 'Trans proline' 0 C--N 1.354 0.848 1 C-N-CA 125.375 4.05 . . . . 0.0 117.592 -171.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.585 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.1 -9.24 37.47 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 177.511 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 61.0 m -133.47 -0.64 3.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.929 2.092 . . . . 0.0 113.736 176.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -54.44 138.52 59.49 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 126.116 1.766 . . . . 0.0 111.256 174.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -46.17 -41.1 21.83 Favored 'Trans proline' 0 CA--C 1.547 1.172 0 C-N-CA 123.696 2.931 . . . . 0.0 117.967 -176.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -61.97 -22.61 74.61 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 123.328 2.685 . . . . 0.0 115.078 175.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -96.42 -10.58 27.25 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.764 1.226 . . . . 0.0 112.954 172.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.2 40.76 5.28 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.738 2.015 . . . . 0.0 115.317 176.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 CA--C 1.553 1.075 0 C-N-CA 126.442 1.897 . . . . 0.0 114.703 -177.104 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.703 0.287 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.585 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.8 t70 -134.47 -48.69 0.03 OUTLIER Pre-proline 0 CA--C 1.548 0.895 0 CA-C-O 117.319 -1.324 . . . . 0.0 113.461 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.585 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 57.9 Cg_endo -72.59 -36.45 5.01 Favored 'Trans proline' 0 C--N 1.356 0.922 0 CA-C-N 121.872 1.704 . . . . 0.0 112.984 175.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.24 38.01 3.13 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 127.361 2.264 . . . . 0.0 114.911 174.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 99.0 mt -74.57 -27.7 60.61 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -175.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -147.46 -1.43 0.62 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.674 1.19 . . . . 0.0 113.837 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.627 0 O-C-N 121.057 -1.027 . . . . 0.0 113.235 -177.807 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 . . . . . 0 N--CA 1.471 0.593 0 CA-C-O 119.742 -0.17 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptm85 -71.1 -37.88 72.37 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 -167.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -93.15 -30.15 15.38 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.209 1.004 . . . . 0.0 111.621 177.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.33 -44.3 76.0 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 123.757 0.694 . . . . 0.0 112.606 166.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.609 0 CA-C-N 117.966 0.883 . . . . 0.0 113.042 174.438 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.5 t70 . . . . . 0 CA--C 1.549 0.925 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -119.31 -14.1 9.24 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -66.86 -49.08 66.81 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.8 1.182 . . . . 0.0 111.255 161.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 81.0 p -63.01 -15.68 57.25 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.29 -11.84 60.08 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 171.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.189 0 CA-C-O 117.677 -1.624 . . . . 0.0 116.626 -179.071 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 113.788 1.032 . . . . 0.0 113.788 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.09 44.97 19.5 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.139 1.376 . . . . 0.0 112.525 -170.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.3 tpt85 -123.93 17.06 9.35 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.934 2.494 . . . . 0.0 111.454 -165.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.68 22.06 62.68 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.452 1.025 . . . . 0.0 114.226 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.5 p 42.45 79.97 0.3 Allowed Pre-proline 0 N--CA 1.481 1.098 0 C-N-CA 127.055 2.142 . . . . 0.0 113.592 -174.311 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -40.6 -44.93 4.58 Favored 'Trans proline' 0 C--N 1.355 0.872 1 C-N-CA 125.659 4.24 . . . . 0.0 117.865 -169.572 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.606 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.0 -8.49 23.25 Favored 'General case' 0 CA--C 1.551 1.005 0 N-CA-C 115.705 1.742 . . . . 0.0 115.705 177.83 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.5 m -134.0 11.19 3.93 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 127.002 2.121 . . . . 0.0 113.017 176.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -65.89 141.01 97.43 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.401 1.081 . . . . 0.0 110.484 176.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -50.26 -40.05 52.35 Favored 'Trans proline' 0 CA--C 1.549 1.242 0 C-N-CA 122.713 2.275 . . . . 0.0 116.138 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -58.61 -20.39 49.95 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 124.258 3.305 . . . . 0.0 116.174 171.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -104.06 -3.95 23.89 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.377 1.471 . . . . 0.0 112.802 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.14 38.77 3.47 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.09 2.156 . . . . 0.0 115.286 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.8 mp . . . . . 0 CA--C 1.554 1.11 0 C-N-CA 126.475 1.91 . . . . 0.0 114.195 -177.593 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 110.505 -0.183 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -66.96 -48.07 51.58 Favored Pre-proline 0 CA--C 1.554 1.098 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 175.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.88 -35.85 1.3 Allowed 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 121.865 1.71 . . . . 0.0 113.496 -178.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 45.81 35.15 2.13 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 127.16 2.184 . . . . 0.0 114.886 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.4 mt -74.29 -27.39 60.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 -175.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -147.86 -4.55 0.49 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.672 0 O-C-N 121.112 -0.992 . . . . 0.0 113.501 -176.54 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.2 mtm180 . . . . . 0 N--CA 1.472 0.672 0 CA-C-O 120.363 0.125 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -73.2 -49.85 25.74 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.96 1.304 . . . . 0.0 114.014 -168.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -80.47 -30.05 37.46 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.75 0.82 . . . . 0.0 111.259 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.28 -44.4 89.37 Favored Glycine 0 CA--C 1.535 1.328 0 C-N-CA 123.896 0.76 . . . . 0.0 113.068 167.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.603 0 CA-C-N 118.164 0.982 . . . . 0.0 112.753 174.018 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 CA--C 1.548 0.89 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -118.52 -15.55 9.59 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 114.517 1.302 . . . . 0.0 114.517 172.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.3 t-105 -65.26 -50.6 65.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.588 1.085 . . . . 0.0 111.091 161.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.4 p -62.28 -20.52 64.38 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.04 -12.28 59.46 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 173.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.355 0 CA-C-O 117.942 -1.476 . . . . 0.0 115.818 -179.772 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 113.842 1.053 . . . . 0.0 113.842 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.48 42.33 14.31 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.442 1.497 . . . . 0.0 112.879 -171.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.1 tpt85 -122.73 15.93 10.22 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.355 2.262 . . . . 0.0 111.68 -168.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.6 26.51 42.33 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 124.4 1.0 . . . . 0.0 114.238 174.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.6 p 43.46 74.29 0.8 Allowed Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.702 2.001 . . . . 0.0 113.205 -176.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -41.36 -43.5 5.65 Favored 'Trans proline' 0 C--N 1.354 0.841 1 C-N-CA 125.453 4.102 . . . . 0.0 117.727 -169.003 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.589 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.96 -9.54 22.25 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 178.093 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -133.2 5.65 3.82 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 126.577 1.951 . . . . 0.0 113.267 176.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -65.03 138.67 97.52 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.767 1.227 . . . . 0.0 110.608 174.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -47.61 -40.12 30.18 Favored 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 123.377 2.718 . . . . 0.0 117.653 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.02 -20.51 69.88 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.344 2.696 . . . . 0.0 115.23 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -99.02 -2.41 37.3 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.02 1.328 . . . . 0.0 112.707 172.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.71 37.66 3.54 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.08 2.152 . . . . 0.0 115.46 176.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp . . . . . 0 CA--C 1.554 1.132 0 C-N-CA 126.422 1.889 . . . . 0.0 114.045 -177.714 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 120.452 0.168 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.58 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 28.2 t70 -129.34 -47.28 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 125.334 1.454 . . . . 0.0 114.118 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.58 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 61.3 Cg_endo -73.35 -34.01 6.43 Favored 'Trans proline' 0 C--N 1.355 0.917 0 CA-C-N 122.037 1.763 . . . . 0.0 112.904 175.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 45.7 35.54 2.23 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 127.476 2.311 . . . . 0.0 115.014 173.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.71 -32.21 69.34 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -175.127 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -147.94 1.07 0.65 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.664 0 O-C-N 121.046 -1.034 . . . . 0.0 113.246 -176.811 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 . . . . . 0 N--CA 1.472 0.648 0 N-CA-C 110.788 -0.078 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -68.53 -49.41 59.78 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.783 1.233 . . . . 0.0 113.652 -168.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -83.36 -30.77 27.16 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.745 0.818 . . . . 0.0 111.365 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.46 -44.88 85.34 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.138 0.875 . . . . 0.0 113.011 169.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.626 0 CA-C-N 118.037 0.919 . . . . 0.0 112.83 174.515 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.5 t70 . . . . . 0 CA--C 1.547 0.837 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -115.35 -13.14 11.68 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 173.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.4 t-105 -67.1 -53.23 32.77 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.451 1.023 . . . . 0.0 111.125 159.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.0 p -63.43 -18.82 64.13 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.76 -16.47 57.93 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.679 1.191 . . . . 0.0 114.126 171.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.359 0 CA-C-O 118.15 -1.361 . . . . 0.0 115.335 177.418 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.76 42.99 16.54 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.392 1.477 . . . . 0.0 112.808 -172.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.8 tpt85 -120.61 8.8 10.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.77 2.428 . . . . 0.0 111.844 -166.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.52 21.95 59.27 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.581 1.086 . . . . 0.0 113.913 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.294 7.5 p 42.63 77.95 0.41 Allowed Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 127.121 2.168 . . . . 0.0 113.545 -177.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -39.87 -43.84 3.46 Favored 'Trans proline' 0 C--N 1.356 0.923 1 C-N-CA 125.954 4.436 . . . . 0.0 118.128 -166.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.615 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.92 -9.4 20.99 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.715 1.746 . . . . 0.0 115.715 178.293 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.3 m -134.75 7.48 3.51 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.677 1.991 . . . . 0.0 113.118 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -63.13 138.87 97.45 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.83 1.252 . . . . 0.0 111.011 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.45 -40.91 29.46 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 123.427 2.751 . . . . 0.0 117.526 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -63.45 -22.32 71.24 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.237 2.625 . . . . 0.0 115.1 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -95.95 -10.86 27.61 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.734 1.214 . . . . 0.0 112.863 172.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.08 42.54 6.68 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.879 2.071 . . . . 0.0 115.018 177.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 CA--C 1.553 1.065 0 C-N-CA 126.576 1.951 . . . . 0.0 114.376 -178.399 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.1 mmt180 . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -68.74 -47.56 32.69 Favored Pre-proline 0 CA--C 1.553 1.08 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 173.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.76 -36.9 1.38 Allowed 'Trans proline' 0 C--N 1.357 1.008 0 CA-C-N 121.868 1.703 . . . . 0.0 113.299 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 44.68 35.6 1.48 Allowed 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 127.429 2.292 . . . . 0.0 115.149 176.448 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -70.72 -32.48 69.68 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -148.08 1.9 0.66 Allowed 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 178.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.658 0 C-N-CA 124.207 1.003 . . . . 0.0 113.293 -177.126 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.9 mtm180 . . . . . 0 N--CA 1.472 0.664 0 CA-C-O 120.041 -0.028 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -68.75 -50.69 48.48 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.453 1.101 . . . . 0.0 113.669 -169.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -81.43 -31.12 33.27 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.705 0.802 . . . . 0.0 111.386 177.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.45 -43.7 90.28 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 123.996 0.808 . . . . 0.0 113.239 169.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.592 0 CA-C-N 118.219 1.01 . . . . 0.0 112.782 174.482 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 t70 . . . . . 0 CA--C 1.549 0.909 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -117.77 -13.3 10.16 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 65.5 t-105 -65.37 -52.27 54.73 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.574 1.079 . . . . 0.0 110.911 158.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.1 p -62.66 -20.34 64.72 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.87 -14.87 56.84 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.285 0 CA-C-O 118.198 -1.335 . . . . 0.0 115.089 177.638 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.79 43.44 17.04 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.328 1.451 . . . . 0.0 112.708 -172.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -120.83 13.42 11.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.763 2.425 . . . . 0.0 111.501 -166.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.3 25.24 48.66 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.344 0.973 . . . . 0.0 114.015 177.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.276 7.4 p 44.25 76.47 0.53 Allowed Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.705 2.002 . . . . 0.0 113.326 -177.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -41.82 -43.49 6.73 Favored 'Trans proline' 0 C--N 1.354 0.816 1 C-N-CA 125.31 4.007 . . . . 0.0 117.501 -170.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.591 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.25 -7.93 27.92 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 178.219 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.9 m -132.37 4.47 4.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.661 1.985 . . . . 0.0 113.31 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -65.18 138.65 97.34 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.986 1.314 . . . . 0.0 111.029 178.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -47.85 -41.01 32.46 Favored 'Trans proline' 0 CA--C 1.548 1.206 0 C-N-CA 123.488 2.792 . . . . 0.0 117.475 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.64 -20.8 71.9 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.342 2.695 . . . . 0.0 115.052 175.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -97.13 -3.15 41.64 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.918 1.287 . . . . 0.0 112.806 172.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 46.01 38.43 4.67 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.727 2.011 . . . . 0.0 115.028 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 CA--C 1.552 1.043 0 C-N-CA 126.393 1.877 . . . . 0.0 115.022 -174.939 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 110.811 -0.07 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -68.35 -48.06 36.1 Favored Pre-proline 0 CA--C 1.554 1.105 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 172.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -76.48 -42.2 0.38 Allowed 'Trans proline' 0 C--N 1.357 0.993 0 CA-C-N 121.924 1.723 . . . . 0.0 113.364 -178.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.74 33.93 1.07 Allowed 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 127.271 2.229 . . . . 0.0 114.907 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.4 mt -72.57 -31.02 64.91 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.985 -1.072 . . . . 0.0 113.601 -176.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -147.55 3.15 0.75 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.509 1.124 . . . . 0.0 113.891 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.681 0 O-C-N 121.029 -1.044 . . . . 0.0 113.269 -176.442 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.9 mtm180 . . . . . 0 N--CA 1.473 0.703 0 CA-C-O 120.387 0.137 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -67.23 -52.15 44.54 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.188 1.395 . . . . 0.0 113.792 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -80.94 -29.64 35.39 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.595 0.758 . . . . 0.0 111.48 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.9 -42.36 86.11 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.06 0.838 . . . . 0.0 113.209 168.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.657 0 CA-C-N 118.014 0.907 . . . . 0.0 112.927 173.667 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.8 t70 . . . . . 0 CA--C 1.547 0.853 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -112.66 -14.91 13.09 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 172.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -65.55 -52.68 50.63 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 119.41 1.004 . . . . 0.0 111.14 161.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.2 p -63.19 -20.83 65.77 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.65 -16.05 62.21 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 173.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.347 0 CA-C-O 118.327 -1.263 . . . . 0.0 115.064 177.989 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.14 45.69 19.66 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.117 1.367 . . . . 0.0 112.355 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.9 tpt85 -122.07 14.36 10.62 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.788 2.435 . . . . 0.0 111.657 -163.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.65 21.6 71.66 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-O 118.701 -1.055 . . . . 0.0 113.734 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.287 6.7 p 42.01 81.58 0.24 Allowed Pre-proline 0 N--CA 1.48 1.04 0 C-N-CA 127.406 2.283 . . . . 0.0 113.688 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -41.27 -43.43 5.43 Favored 'Trans proline' 0 C--N 1.354 0.839 1 C-N-CA 125.623 4.215 . . . . 0.0 118.085 -166.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.636 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.64 -7.74 22.61 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 178.306 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.5 m -127.95 -3.53 5.79 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.476 1.91 . . . . 0.0 113.4 175.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -62.2 137.28 95.79 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.18 1.392 . . . . 0.0 111.044 175.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.02 -39.64 33.07 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.481 2.787 . . . . 0.0 117.662 -178.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -61.61 -17.3 53.55 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.488 2.792 . . . . 0.0 115.516 174.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -107.25 2.27 24.53 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.395 1.478 . . . . 0.0 112.709 172.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 42.76 47.13 4.64 Favored 'General case' 0 CA--C 1.55 0.981 0 C-N-CA 127.353 2.261 . . . . 0.0 115.881 172.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 18.8 mt . . . . . 0 N--CA 1.481 1.076 0 C-N-CA 125.808 1.643 . . . . 0.0 114.69 -179.817 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.56 0.219 . . . . 0.0 111.37 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.576 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 28.2 t70 -130.83 -47.9 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.983 0 C-N-CA 125.26 1.424 . . . . 0.0 114.138 -178.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.576 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 60.1 Cg_endo -73.2 -33.96 6.7 Favored 'Trans proline' 0 C--N 1.357 0.988 0 CA-C-N 122.211 1.825 . . . . 0.0 113.028 175.562 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.75 30.13 1.75 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.415 2.286 . . . . 0.0 115.355 175.437 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.15 -33.99 74.29 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.011 -1.056 . . . . 0.0 113.724 -175.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -149.04 2.17 0.57 Allowed 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.633 0 C-N-CA 124.415 1.086 . . . . 0.0 113.307 -176.854 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.0 mtm180 . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 120.153 0.025 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -69.35 -40.86 77.25 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -168.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -91.3 -29.15 17.31 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.146 0.979 . . . . 0.0 111.418 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.52 -42.99 77.63 Favored Glycine 0 CA--C 1.538 1.483 0 C-N-CA 123.908 0.766 . . . . 0.0 112.946 167.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.599 0 CA-C-N 117.987 0.894 . . . . 0.0 113.083 174.056 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 CA--C 1.547 0.851 0 N-CA-C 114.436 1.272 . . . . 0.0 114.436 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -115.8 -14.4 11.36 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 172.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -65.99 -51.95 53.83 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.529 1.059 . . . . 0.0 111.087 160.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.2 p -62.85 -19.0 63.7 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.83 -15.23 58.32 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.29 1.219 . . . . 0.0 114.29 172.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.313 0 CA-C-O 118.291 -1.283 . . . . 0.0 115.211 177.67 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.77 44.17 17.6 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.173 1.389 . . . . 0.0 112.522 -171.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.6 tpt85 -121.68 12.83 10.72 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 127.724 2.41 . . . . 0.0 111.662 -165.027 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.46 22.82 57.88 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.576 1.084 . . . . 0.0 114.056 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.286 7.3 p 43.34 77.32 0.45 Allowed Pre-proline 0 N--CA 1.479 1.018 0 C-N-CA 126.866 2.067 . . . . 0.0 113.392 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -40.57 -43.57 4.29 Favored 'Trans proline' 0 C--N 1.355 0.881 1 C-N-CA 125.61 4.207 . . . . 0.0 117.985 -167.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.592 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.73 -9.48 20.44 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 178.03 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.3 m -134.08 6.14 3.61 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.688 1.995 . . . . 0.0 113.26 176.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -64.09 139.43 97.68 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 124.747 1.219 . . . . 0.0 110.704 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.19 -40.55 27.36 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 123.456 2.771 . . . . 0.0 117.623 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -62.34 -21.74 73.09 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.35 2.7 . . . . 0.0 115.194 174.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -98.44 -7.4 28.67 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.939 1.296 . . . . 0.0 112.782 172.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.79 40.92 4.62 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.028 2.131 . . . . 0.0 115.321 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.5 mp . . . . . 0 CA--C 1.553 1.059 0 C-N-CA 126.468 1.907 . . . . 0.0 114.225 -178.338 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 110.826 -0.064 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -74.01 -47.67 6.36 Favored Pre-proline 0 CA--C 1.553 1.091 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 174.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.66 -32.73 2.64 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 121.915 1.743 . . . . 0.0 113.526 -176.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.95 31.56 2.42 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 127.257 2.223 . . . . 0.0 115.583 174.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.35 -34.74 75.04 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -173.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -148.44 0.78 0.6 Allowed 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.704 0 C-N-CA 124.39 1.076 . . . . 0.0 113.504 -176.11 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 120.5 0.191 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -73.25 -46.81 47.85 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.946 1.298 . . . . 0.0 114.044 -168.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -82.05 -27.64 32.9 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.597 0.759 . . . . 0.0 111.243 175.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.23 -43.31 84.09 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 123.977 0.799 . . . . 0.0 113.172 166.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.688 0 CA-C-N 118.142 0.971 . . . . 0.0 113.103 174.201 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 CA--C 1.548 0.879 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -117.87 -10.84 10.37 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 172.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -68.0 -51.45 47.04 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.649 1.113 . . . . 0.0 111.065 158.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.8 p -63.18 -16.13 59.13 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.99 -13.73 58.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 171.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.287 0 CA-C-O 117.929 -1.484 . . . . 0.0 116.122 179.983 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.47 42.85 15.08 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.32 1.448 . . . . 0.0 112.785 -171.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.8 tpt85 -116.79 12.73 14.91 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.626 2.371 . . . . 0.0 111.732 -167.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.87 20.91 60.34 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 124.588 1.09 . . . . 0.0 113.937 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.4 p 41.61 77.89 0.41 Allowed Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 126.989 2.115 . . . . 0.0 113.245 -175.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -41.17 -41.26 4.52 Favored 'Trans proline' 0 C--N 1.354 0.863 1 C-N-CA 125.883 4.389 . . . . 0.0 118.496 -165.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.585 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.29 -9.61 18.64 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 176.808 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 65.3 m -133.57 14.05 4.08 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.108 2.163 . . . . 0.0 112.917 177.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.58 140.35 96.45 Favored Pre-proline 0 CA--C 1.551 1.015 0 O-C-N 120.896 -1.128 . . . . 0.0 111.224 177.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -51.82 -39.97 66.89 Favored 'Trans proline' 0 CA--C 1.549 1.227 0 C-N-CA 122.941 2.427 . . . . 0.0 116.193 174.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -60.36 -21.63 68.04 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.484 2.79 . . . . 0.0 115.618 172.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -95.72 0.76 52.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.885 1.274 . . . . 0.0 112.629 171.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 47.03 33.95 2.56 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.909 2.084 . . . . 0.0 114.803 -177.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 CA--C 1.553 1.072 0 C-N-CA 126.477 1.911 . . . . 0.0 114.008 -175.831 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 110.727 -0.101 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -70.57 -49.39 15.72 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 173.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -79.8 -34.89 0.84 Allowed 'Trans proline' 0 C--N 1.357 0.976 0 CA-C-N 121.874 1.705 . . . . 0.0 113.684 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 43.32 37.95 1.52 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 127.295 2.238 . . . . 0.0 113.982 -176.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.6 -39.3 77.35 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.494 1.118 . . . . 0.0 112.562 -171.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -143.99 2.67 1.19 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.812 1.245 . . . . 0.0 113.534 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.682 0 O-C-N 120.969 -1.082 . . . . 0.0 113.414 -176.38 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 120.421 0.153 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -69.64 -53.7 17.46 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.223 1.409 . . . . 0.0 113.801 -169.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -77.44 -31.14 53.68 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.645 0.778 . . . . 0.0 111.427 177.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -57.2 -42.76 93.52 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.141 0.877 . . . . 0.0 113.364 169.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.61 0 CA-C-N 118.183 0.992 . . . . 0.0 112.776 173.857 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 . . . . . 0 CA--C 1.549 0.91 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -113.54 -13.31 12.79 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 172.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.8 t-105 -67.49 -51.8 46.85 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.475 1.034 . . . . 0.0 111.192 160.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.6 p -63.51 -17.9 63.25 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.422 1.268 . . . . 0.0 114.422 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.85 -16.17 57.45 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.681 1.192 . . . . 0.0 114.192 171.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.295 0 C-N-CA 124.862 1.22 . . . . 0.0 114.85 175.821 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.63 43.66 16.6 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.242 1.417 . . . . 0.0 112.581 -170.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -117.57 10.47 13.48 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 127.502 2.321 . . . . 0.0 112.086 -165.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.96 21.52 65.52 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 118.805 -0.997 . . . . 0.0 113.676 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.288 7.2 p 40.16 78.54 0.36 Allowed Pre-proline 0 N--CA 1.48 1.05 0 C-N-CA 127.3 2.24 . . . . 0.0 113.513 -177.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -40.1 -41.86 3.24 Favored 'Trans proline' 0 C--N 1.355 0.897 1 C-N-CA 126.091 4.527 . . . . 0.0 118.71 -164.124 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.613 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.52 -9.33 12.55 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 177.283 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.9 m -129.32 9.17 5.59 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.517 1.927 . . . . 0.0 113.004 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -70.49 140.04 87.03 Favored Pre-proline 0 CA--C 1.551 0.992 0 O-C-N 120.94 -1.1 . . . . 0.0 111.301 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -51.3 -39.79 62.32 Favored 'Trans proline' 0 CA--C 1.548 1.207 0 C-N-CA 123.177 2.585 . . . . 0.0 116.511 175.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -60.07 -20.38 60.68 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.548 2.832 . . . . 0.0 115.709 172.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.16 2.16 42.73 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.045 1.338 . . . . 0.0 112.575 172.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 46.29 37.06 3.74 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.721 2.009 . . . . 0.0 114.653 -178.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.2 mp . . . . . 0 CA--C 1.553 1.075 0 C-N-CA 126.413 1.885 . . . . 0.0 114.104 -176.859 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 120.44 0.162 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.468 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.7 t70 -113.23 -48.15 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.085 1.354 . . . . 0.0 113.65 176.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 69.7 Cg_endo -75.7 -36.39 2.18 Favored 'Trans proline' 0 C--N 1.357 0.98 0 CA-C-N 122.049 1.767 . . . . 0.0 113.112 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 43.01 37.97 1.29 Allowed 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 127.544 2.337 . . . . 0.0 114.713 178.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 98.2 mt -70.91 -32.45 69.38 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -148.63 3.29 0.64 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.686 0 O-C-N 121.025 -1.047 . . . . 0.0 113.195 -176.918 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 . . . . . 0 N--CA 1.474 0.727 0 CA-C-O 120.168 0.032 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -68.69 -48.06 64.86 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.875 1.27 . . . . 0.0 114.153 -169.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -83.77 -29.53 27.35 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.803 0.841 . . . . 0.0 111.408 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.57 -41.93 89.72 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 123.999 0.809 . . . . 0.0 113.172 168.156 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.584 0 CA-C-N 118.142 0.971 . . . . 0.0 112.834 173.892 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 CA--C 1.548 0.887 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -114.17 -11.55 12.64 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 172.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -68.4 -53.49 23.47 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.48 1.036 . . . . 0.0 110.995 158.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.9 p -63.63 -17.62 63.09 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.37 -16.37 54.18 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.325 1.232 . . . . 0.0 114.325 171.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.288 0 CA-C-O 118.034 -1.426 . . . . 0.0 115.671 178.172 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.26 45.12 20.14 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.98 1.312 . . . . 0.0 112.44 -170.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -121.85 12.81 10.59 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 127.938 2.495 . . . . 0.0 111.736 -164.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.6 20.53 68.56 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.519 1.057 . . . . 0.0 114.003 -178.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.292 7.6 p 43.35 80.1 0.3 Allowed Pre-proline 0 N--CA 1.48 1.031 0 C-N-CA 127.167 2.187 . . . . 0.0 113.499 -176.702 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -41.04 -43.74 4.96 Favored 'Trans proline' 0 C--N 1.355 0.898 1 C-N-CA 125.721 4.281 . . . . 0.0 117.882 -167.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.602 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.53 -7.48 20.25 Favored 'General case' 0 CA--C 1.551 1.018 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 178.497 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.1 m -130.73 -3.24 4.16 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.475 1.91 . . . . 0.0 113.513 175.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.17 138.77 91.48 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 125.69 1.596 . . . . 0.0 111.498 178.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -46.93 -38.93 24.31 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 123.598 2.865 . . . . 0.0 117.997 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -63.17 -20.66 71.47 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.365 2.71 . . . . 0.0 115.171 173.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -103.44 -13.29 16.68 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.147 1.379 . . . . 0.0 112.888 172.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.37 51.43 7.68 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 127.103 2.161 . . . . 0.0 115.039 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 32.9 mt . . . . . 0 N--CA 1.48 1.064 0 C-N-CA 126.36 1.864 . . . . 0.0 114.899 -179.526 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 120.896 0.379 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.563 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.9 t70 -131.89 -48.43 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.309 1.444 . . . . 0.0 113.93 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.563 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 57.1 Cg_endo -72.95 -38.47 2.89 Favored 'Trans proline' 0 C--N 1.356 0.923 0 CA-C-N 122.137 1.799 . . . . 0.0 112.801 174.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.58 36.22 2.46 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 127.309 2.244 . . . . 0.0 114.645 176.172 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.9 mt -76.4 -24.35 54.05 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -176.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -147.36 -1.62 0.62 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.667 0 O-C-N 121.028 -1.045 . . . . 0.0 113.413 -177.513 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 120.527 0.203 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -71.38 -34.57 70.54 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -168.155 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -99.27 -27.36 13.82 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.474 1.109 . . . . 0.0 111.337 176.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.4 -40.02 75.32 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.753 0.692 . . . . 0.0 112.894 164.177 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.646 0 CA-C-N 118.083 0.941 . . . . 0.0 112.933 172.533 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.5 t70 . . . . . 0 CA--C 1.55 0.963 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -120.63 -11.72 9.01 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 70.8 t-105 -65.3 -50.17 66.71 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.664 1.12 . . . . 0.0 110.91 159.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.5 p -62.03 -16.63 53.23 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.19 -13.9 61.01 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 171.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.394 0 CA-C-O 117.874 -1.514 . . . . 0.0 116.14 179.806 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.78 45.21 18.37 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.392 1.477 . . . . 0.0 112.385 -171.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 tpt85 -124.93 15.06 8.56 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 127.963 2.505 . . . . 0.0 111.638 -163.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.3 16.83 68.13 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.724 1.154 . . . . 0.0 114.195 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.303 6.8 p 44.81 80.08 0.31 Allowed Pre-proline 0 N--CA 1.479 1.013 0 C-N-CA 127.07 2.148 . . . . 0.0 113.124 -173.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -41.72 -43.39 6.49 Favored 'Trans proline' 0 C--N 1.356 0.921 1 C-N-CA 125.553 4.169 . . . . 0.0 118.125 -169.223 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.619 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.59 -6.56 20.73 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 177.754 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.4 m -133.06 12.58 4.28 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.968 2.107 . . . . 0.0 112.956 176.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -68.66 141.1 92.47 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.829 1.251 . . . . 0.0 111.1 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -52.84 -40.37 75.13 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 123.237 2.625 . . . . 0.0 115.222 172.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -56.85 -19.21 30.57 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.937 3.091 . . . . 0.0 116.463 169.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -106.47 2.83 26.63 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.155 1.382 . . . . 0.0 112.829 173.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.64 47.19 8.62 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.775 2.03 . . . . 0.0 114.676 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.9 mt . . . . . 0 N--CA 1.479 0.987 0 C-N-CA 126.462 1.905 . . . . 0.0 114.894 -177.892 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.547 0.213 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.541 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.0 t70 -129.56 -48.95 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.201 1.4 . . . . 0.0 113.733 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.541 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.0 Cg_endo -73.4 -38.71 2.42 Favored 'Trans proline' 0 C--N 1.357 1.011 0 CA-C-N 122.034 1.762 . . . . 0.0 112.745 174.255 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.72 34.69 1.87 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 127.294 2.238 . . . . 0.0 114.669 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.4 mt -76.25 -26.22 55.77 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -147.49 0.62 0.69 Allowed 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 -177.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.709 0 C-N-CA 124.364 1.065 . . . . 0.0 113.212 -177.301 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 . . . . . 0 N--CA 1.473 0.687 0 CA-C-O 120.021 -0.038 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -71.23 -30.35 66.24 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 -167.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -102.81 -28.8 11.85 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.799 1.24 . . . . 0.0 111.333 174.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.3 -41.97 81.21 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.741 0.686 . . . . 0.0 112.948 166.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.517 0 CA-C-N 118.06 0.93 . . . . 0.0 113.021 174.32 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 CA--C 1.549 0.904 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -117.77 -13.69 10.15 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 171.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -66.71 -50.03 64.13 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.668 1.122 . . . . 0.0 110.924 159.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.5 p -63.93 -13.74 48.09 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.3 -12.14 59.36 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 170.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.302 0 CA-C-O 117.786 -1.563 . . . . 0.0 116.16 -179.791 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 . . . . . 0 N--CA 1.48 1.044 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.18 42.01 16.68 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.437 1.495 . . . . 0.0 113.043 -172.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.2 tpt85 -120.29 8.49 10.86 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.509 2.324 . . . . 0.0 112.102 -168.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.6 20.83 53.24 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.774 1.178 . . . . 0.0 114.212 176.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.296 7.2 p 43.5 77.68 0.43 Allowed Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 126.82 2.048 . . . . 0.0 113.441 -174.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -41.18 -42.82 5.1 Favored 'Trans proline' 0 C--N 1.355 0.91 1 C-N-CA 125.724 4.283 . . . . 0.0 118.051 -168.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.58 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -65.25 -9.48 24.28 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 177.957 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.9 m -134.09 11.96 3.91 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.659 1.984 . . . . 0.0 112.91 176.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -64.37 140.82 98.05 Favored Pre-proline 0 CA--C 1.548 0.881 0 O-C-N 120.885 -1.134 . . . . 0.0 111.089 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -53.15 -41.51 71.57 Favored 'Trans proline' 0 CA--C 1.55 1.322 0 C-N-CA 122.424 2.083 . . . . 0.0 115.482 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -54.83 -22.22 28.91 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 124.222 3.281 . . . . 0.0 116.764 169.304 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -100.19 -6.17 26.53 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.572 1.149 . . . . 0.0 113.114 173.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.87 45.48 8.51 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.359 1.864 . . . . 0.0 114.595 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.479 1.016 0 C-N-CA 126.859 2.063 . . . . 0.0 115.16 -177.348 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 120.625 0.25 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.527 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.4 t70 -135.45 -49.86 0.02 OUTLIER Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.086 1.355 . . . . 0.0 113.684 178.396 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.527 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 59.7 Cg_endo -73.58 -34.2 5.91 Favored 'Trans proline' 0 C--N 1.358 1.034 0 CA-C-N 121.975 1.741 . . . . 0.0 113.035 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 43.54 38.35 1.83 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 127.508 2.323 . . . . 0.0 114.195 178.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.85 -30.67 62.8 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.272 1.029 . . . . 0.0 113.23 -173.666 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -145.54 -0.77 0.83 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.695 0 O-C-N 121.029 -1.045 . . . . 0.0 113.365 -176.957 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.7 mtm180 . . . . . 0 N--CA 1.474 0.757 0 CA-C-O 120.377 0.132 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -72.08 -43.84 64.21 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.267 1.427 . . . . 0.0 114.568 -169.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -88.22 -27.05 22.05 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.998 0.919 . . . . 0.0 111.48 175.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.24 -43.0 89.31 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 123.612 0.625 . . . . 0.0 112.76 165.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.525 0 CA-C-N 118.048 0.924 . . . . 0.0 112.988 173.651 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.2 t70 . . . . . 0 CA--C 1.548 0.897 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -119.7 -15.43 8.93 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 172.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -67.05 -50.38 62.1 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.387 0.994 . . . . 0.0 111.125 162.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.1 p -63.32 -19.59 64.74 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.9 -14.14 58.85 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 172.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.318 0 CA-C-O 118.008 -1.44 . . . . 0.0 115.377 178.145 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.34 43.52 19.34 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.152 1.381 . . . . 0.0 112.649 -172.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -122.54 9.61 9.65 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.84 2.456 . . . . 0.0 111.887 -164.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.44 21.76 53.22 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.592 1.091 . . . . 0.0 114.233 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.294 7.1 p 43.83 76.01 0.58 Allowed Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 126.804 2.042 . . . . 0.0 113.235 -176.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -40.72 -43.21 4.42 Favored 'Trans proline' 0 C--N 1.355 0.877 1 C-N-CA 125.763 4.309 . . . . 0.0 117.974 -167.268 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.605 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.03 -9.87 18.61 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.185 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.0 m -131.81 3.29 4.11 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.3 1.84 . . . . 0.0 113.464 175.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -64.95 138.87 97.62 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 124.95 1.3 . . . . 0.0 111.17 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -47.63 -40.36 30.51 Favored 'Trans proline' 0 CA--C 1.548 1.213 0 C-N-CA 123.651 2.901 . . . . 0.0 117.705 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -61.65 -20.61 69.51 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.411 2.74 . . . . 0.0 115.202 174.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -99.52 -2.53 35.62 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.925 1.29 . . . . 0.0 112.776 172.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.81 38.69 4.55 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.755 2.022 . . . . 0.0 115.137 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 CA--C 1.553 1.066 0 C-N-CA 126.337 1.855 . . . . 0.0 114.484 -176.552 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 120.6 0.238 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.533 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.0 t70 -128.41 -48.51 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.235 1.414 . . . . 0.0 113.816 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.533 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.7 Cg_endo -73.49 -38.84 2.29 Favored 'Trans proline' 0 C--N 1.356 0.921 0 CA-C-N 122.086 1.781 . . . . 0.0 112.71 174.544 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.43 34.92 1.71 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 127.315 2.246 . . . . 0.0 114.728 177.435 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.5 mt -75.56 -26.15 57.71 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.04 -1.037 . . . . 0.0 113.704 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -147.89 -0.93 0.6 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -178.17 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.697 0 O-C-N 121.096 -1.002 . . . . 0.0 113.325 -176.803 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.2 mtm180 . . . . . 0 N--CA 1.472 0.675 0 CA-C-O 120.486 0.184 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -69.82 -40.03 76.13 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.238 1.415 . . . . 0.0 114.538 -168.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -93.63 -29.59 15.38 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.393 1.077 . . . . 0.0 111.249 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.46 -41.33 80.47 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 123.876 0.75 . . . . 0.0 113.184 168.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.656 0 CA-C-N 118.072 0.936 . . . . 0.0 112.807 173.099 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.3 t70 . . . . . 0 CA--C 1.549 0.911 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -121.75 -19.0 6.94 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 171.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -62.0 -47.58 84.15 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.624 1.102 . . . . 0.0 111.308 164.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.0 p -61.97 -24.96 67.33 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.14 -5.91 42.25 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.333 0 C-N-CA 124.941 1.258 . . . . 0.0 114.558 177.105 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.44 40.72 15.48 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.667 1.587 . . . . 0.0 113.339 -173.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -113.12 11.96 18.99 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 127.167 2.187 . . . . 0.0 111.969 -171.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.96 26.02 35.85 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 118.911 -0.938 . . . . 0.0 113.921 175.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.283 8.8 p 43.63 72.95 1.04 Allowed Pre-proline 0 N--CA 1.48 1.028 0 C-N-CA 126.644 1.978 . . . . 0.0 113.359 -177.184 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -41.54 -41.81 5.62 Favored 'Trans proline' 0 C--N 1.355 0.881 1 C-N-CA 125.64 4.227 . . . . 0.0 117.9 -168.435 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.613 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.27 -10.1 21.62 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 115.666 1.728 . . . . 0.0 115.666 177.629 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.9 m -133.36 3.26 3.61 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.222 1.809 . . . . 0.0 113.666 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -61.86 138.75 95.57 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.02 1.328 . . . . 0.0 111.148 176.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -47.01 -40.86 26.22 Favored 'Trans proline' 0 CA--C 1.548 1.217 0 C-N-CA 123.64 2.893 . . . . 0.0 117.79 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.47 -21.14 72.39 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.24 2.626 . . . . 0.0 115.043 175.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -97.29 -6.63 33.98 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.859 1.263 . . . . 0.0 112.81 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.34 40.26 5.15 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 126.964 2.105 . . . . 0.0 115.104 177.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.1 mp . . . . . 0 CA--C 1.553 1.067 0 C-N-CA 126.564 1.945 . . . . 0.0 115.007 -175.257 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 120.588 0.233 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.54 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.4 t70 -132.19 -49.09 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.993 0 CA-C-O 117.208 -1.377 . . . . 0.0 113.845 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.54 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.2 Cg_endo -73.18 -38.25 2.86 Favored 'Trans proline' 0 C--N 1.357 0.997 0 CA-C-N 122.14 1.8 . . . . 0.0 112.729 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.45 33.31 1.89 Allowed 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 127.244 2.218 . . . . 0.0 114.799 175.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.3 mt -73.69 -28.2 61.62 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.074 -1.016 . . . . 0.0 113.563 -176.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -148.06 2.08 0.67 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.702 0 O-C-N 121.118 -0.988 . . . . 0.0 113.182 -177.187 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 110.86 -0.052 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -66.77 -46.06 76.53 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.862 1.265 . . . . 0.0 114.205 -169.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -88.72 -30.16 19.29 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.128 0.971 . . . . 0.0 111.407 177.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.33 -42.67 89.26 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 123.889 0.757 . . . . 0.0 113.17 170.111 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.598 0 CA-C-N 118.074 0.937 . . . . 0.0 112.833 173.819 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 t70 . . . . . 0 CA--C 1.547 0.846 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -116.27 -13.41 11.08 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 172.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -67.46 -52.01 44.48 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.489 1.041 . . . . 0.0 111.021 160.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.2 p -62.56 -19.22 63.46 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.45 -13.82 53.64 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 171.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.289 0 CA-C-O 117.836 -1.536 . . . . 0.0 115.722 179.393 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 . . . . . 0 N--CA 1.479 0.983 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.82 37.02 6.54 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.571 1.549 . . . . 0.0 113.106 -171.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 48.5 tpt85 -102.71 -13.62 17.0 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.514 2.326 . . . . 0.0 113.059 -169.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.74 21.29 8.75 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.947 1.261 . . . . 0.0 113.759 -175.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.299 7.7 p 44.86 80.23 0.3 Allowed Pre-proline 0 N--CA 1.48 1.055 0 C-N-CA 127.345 2.258 . . . . 0.0 113.783 -177.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -42.66 -42.33 8.5 Favored 'Trans proline' 0 C--N 1.354 0.862 1 C-N-CA 125.57 4.18 . . . . 0.0 117.961 -170.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.61 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.77 -5.94 18.71 Favored 'General case' 0 CA--C 1.551 1.018 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.621 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.4 m -134.33 12.26 3.84 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 127.221 2.208 . . . . 0.0 112.713 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -65.26 143.59 98.82 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 125.066 1.346 . . . . 0.0 111.931 -177.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.57 -39.6 74.75 Favored 'Trans proline' 0 CA--C 1.548 1.212 0 C-N-CA 123.041 2.494 . . . . 0.0 116.214 173.252 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -60.02 -20.54 61.14 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.668 2.912 . . . . 0.0 115.602 170.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -99.02 6.67 46.54 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.449 1.5 . . . . 0.0 112.321 171.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 48.46 32.63 3.44 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 127.202 2.201 . . . . 0.0 115.123 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.555 1.165 0 C-N-CA 125.587 1.555 . . . . 0.0 113.597 -174.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -68.13 -49.63 33.95 Favored Pre-proline 0 CA--C 1.554 1.108 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 175.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.48 -42.97 0.19 Allowed 'Trans proline' 0 C--N 1.356 0.948 0 CA-C-N 121.845 1.695 . . . . 0.0 113.461 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.2 32.86 1.58 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 126.968 2.107 . . . . 0.0 114.396 -176.098 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.6 mt -79.01 -22.51 45.38 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -177.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -146.57 -1.89 0.68 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.645 0 C-N-CA 124.338 1.055 . . . . 0.0 113.297 -177.624 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.7 mtm180 . . . . . 0 N--CA 1.473 0.678 0 CA-C-O 120.216 0.055 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -68.89 -19.26 64.22 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -167.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -120.9 -33.56 3.73 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.677 1.591 . . . . 0.0 111.297 176.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.64 -41.26 97.3 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.077 0.846 . . . . 0.0 113.813 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.597 0 CA-C-N 118.488 1.144 . . . . 0.0 112.682 174.196 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 CA--C 1.547 0.851 0 N-CA-C 114.617 1.339 . . . . 0.0 114.617 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -111.27 -14.97 13.73 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 173.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 70.9 t-105 -67.56 -52.43 38.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.571 1.078 . . . . 0.0 110.906 160.305 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.3 p -63.32 -19.15 64.35 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.1 -16.92 61.57 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 171.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.338 0 CA-C-O 118.209 -1.329 . . . . 0.0 114.895 176.862 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.92 43.38 17.54 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.211 1.405 . . . . 0.0 112.569 -170.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -121.03 8.22 10.4 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.593 2.357 . . . . 0.0 112.11 -165.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.44 21.44 58.36 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.567 1.08 . . . . 0.0 114.044 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.293 7.1 p 40.47 77.95 0.4 Allowed Pre-proline 0 N--CA 1.481 1.105 0 C-N-CA 127.086 2.154 . . . . 0.0 113.411 -177.008 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -40.05 -42.26 3.29 Favored 'Trans proline' 0 C--N 1.356 0.949 1 C-N-CA 126.032 4.488 . . . . 0.0 118.481 -163.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.615 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -62.92 -8.88 7.95 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.71 1.745 . . . . 0.0 115.71 177.56 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.5 m -127.46 7.57 6.39 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.298 1.839 . . . . 0.0 113.107 176.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -74.15 142.12 78.56 Favored Pre-proline 0 CA--C 1.554 1.116 0 O-C-N 120.909 -1.12 . . . . 0.0 111.477 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -51.58 -38.42 65.08 Favored 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 123.35 2.7 . . . . 0.0 116.992 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -60.06 -20.4 60.68 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.609 2.873 . . . . 0.0 115.447 171.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -102.29 10.0 39.51 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.437 1.495 . . . . 0.0 112.059 171.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 48.47 33.46 4.01 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.129 2.172 . . . . 0.0 115.068 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.555 1.145 0 C-N-CA 125.512 1.525 . . . . 0.0 113.503 -175.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 120.488 0.185 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.542 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.5 t70 -129.03 -48.44 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 125.312 1.445 . . . . 0.0 113.995 178.115 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.542 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 72.9 Cg_endo -74.77 -30.02 8.04 Favored 'Trans proline' 0 C--N 1.356 0.935 0 CA-C-N 121.984 1.744 . . . . 0.0 112.99 174.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 43.21 43.56 4.04 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.727 2.411 . . . . 0.0 114.717 171.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.4 mt -68.82 -37.12 78.98 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -174.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -149.3 3.62 0.59 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.553 1.141 . . . . 0.0 114.054 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.64 -33.87 68.74 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.958 -1.089 . . . . 0.0 113.507 -176.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.3 mtm180 -95.59 -64.54 1.05 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.211 1.004 . . . . 0.0 111.044 171.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -72.04 -33.69 68.2 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -167.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -97.29 -29.86 13.3 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.301 1.041 . . . . 0.0 111.086 175.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -57.28 -41.76 93.15 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.104 0.859 . . . . 0.0 113.359 169.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.4 -44.4 75.14 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 118.013 0.906 . . . . 0.0 112.816 172.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.38 -18.45 61.57 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.271 1.428 . . . . 0.0 114.418 174.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -113.48 -11.83 13.02 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 173.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -67.15 -53.82 27.04 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.369 0.986 . . . . 0.0 110.918 158.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.9 p -63.54 -18.76 64.19 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.54 -16.53 56.52 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 171.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.26 -23.57 0.34 Allowed Glycine 0 CA--C 1.534 1.242 0 CA-C-O 118.255 -1.303 . . . . 0.0 115.134 178.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 68.68 21.48 7.85 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.139 1.776 . . . . 0.0 113.889 -165.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.69 41.05 13.15 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.591 1.556 . . . . 0.0 112.89 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.4 tpt85 -112.92 6.68 17.96 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 127.609 2.364 . . . . 0.0 112.142 -169.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.13 22.23 59.5 Favored Glycine 0 CA--C 1.532 1.146 0 CA-C-O 118.687 -1.063 . . . . 0.0 113.761 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.288 7.1 p 40.4 77.98 0.39 Allowed Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 127.308 2.243 . . . . 0.0 113.441 -177.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -39.09 -44.54 2.62 Favored 'Trans proline' 0 C--N 1.355 0.895 1 C-N-CA 126.101 4.534 . . . . 0.0 118.417 -164.115 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.618 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -62.26 -9.9 9.29 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 178.059 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.7 m -129.9 7.59 5.17 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.512 1.925 . . . . 0.0 113.044 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -71.41 140.06 84.6 Favored Pre-proline 0 CA--C 1.554 1.104 0 O-C-N 121.023 -1.048 . . . . 0.0 110.523 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -48.24 -39.29 34.63 Favored 'Trans proline' 0 CA--C 1.549 1.23 0 C-N-CA 123.492 2.795 . . . . 0.0 117.66 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -61.22 -18.63 59.68 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 123.481 2.787 . . . . 0.0 115.419 173.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -104.23 4.39 33.8 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.517 1.527 . . . . 0.0 112.532 172.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.52 46.7 8.22 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.2 2.2 . . . . 0.0 115.56 173.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.6 mt 59.91 16.77 5.99 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 126.258 1.823 . . . . 0.0 114.731 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 O-C-N 119.585 -1.947 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 120.607 0.242 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.546 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.0 t70 -133.65 -49.05 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.169 1.388 . . . . 0.0 113.796 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.546 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 60.2 Cg_endo -73.03 -33.86 7.05 Favored 'Trans proline' 0 C--N 1.357 0.977 0 CA-C-N 122.06 1.771 . . . . 0.0 112.918 174.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.48 39.53 3.26 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 127.566 2.346 . . . . 0.0 114.873 172.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.5 mt -72.32 -31.74 65.93 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -175.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -148.38 2.93 0.66 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.91 -33.54 68.87 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.99 -1.069 . . . . 0.0 113.42 -177.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.0 mtm180 -98.36 -64.7 1.02 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.323 1.049 . . . . 0.0 110.998 170.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -72.83 -19.03 61.4 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 -167.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -117.3 -28.37 6.17 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.493 1.517 . . . . 0.0 111.339 176.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.88 -41.04 91.23 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.042 0.829 . . . . 0.0 113.22 167.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.44 -43.68 84.96 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.054 0.927 . . . . 0.0 112.811 172.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.11 -17.21 63.22 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.353 1.461 . . . . 0.0 114.446 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -113.27 -13.87 12.9 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 172.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -66.76 -53.37 33.78 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.46 1.027 . . . . 0.0 111.001 160.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.1 p -62.56 -18.65 62.5 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.02 -14.63 60.9 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 171.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -145.62 -17.29 0.17 Allowed Glycine 0 CA--C 1.535 1.294 0 CA-C-O 118.021 -1.433 . . . . 0.0 115.975 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 68.29 19.45 9.0 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.502 1.921 . . . . 0.0 113.868 -165.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.31 43.98 15.61 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 125.375 1.47 . . . . 0.0 112.674 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.1 tpt85 -121.86 19.02 11.01 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.651 2.38 . . . . 0.0 111.341 -166.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.14 23.15 61.79 Favored Glycine 0 CA--C 1.532 1.141 0 CA-C-O 118.854 -0.97 . . . . 0.0 113.969 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.289 7.1 p 42.67 75.99 0.57 Allowed Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 127.043 2.137 . . . . 0.0 113.384 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -40.61 -44.33 4.48 Favored 'Trans proline' 0 C--N 1.354 0.841 1 C-N-CA 125.643 4.229 . . . . 0.0 117.941 -167.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.584 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.99 -8.99 13.23 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 178.171 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.5 m -133.28 5.85 3.81 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.799 2.04 . . . . 0.0 113.217 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -66.88 138.97 95.43 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.577 1.151 . . . . 0.0 110.435 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -47.95 -40.1 32.73 Favored 'Trans proline' 0 CA--C 1.548 1.214 0 C-N-CA 123.278 2.652 . . . . 0.0 117.812 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -61.33 -19.47 64.19 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.36 2.707 . . . . 0.0 115.446 174.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -102.01 -1.7 31.23 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.119 1.368 . . . . 0.0 112.757 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.44 39.11 4.25 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.097 2.159 . . . . 0.0 115.595 175.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.1 mp 59.08 19.06 6.92 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.327 1.851 . . . . 0.0 114.097 -177.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.287 0 O-C-N 119.423 -2.048 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 120.435 0.16 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.474 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.8 t70 -114.04 -47.88 0.05 OUTLIER Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 125.135 1.374 . . . . 0.0 113.805 176.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.474 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 59.6 Cg_endo -74.16 -39.69 1.55 Allowed 'Trans proline' 0 C--N 1.357 1.02 0 CA-C-N 122.05 1.768 . . . . 0.0 112.957 176.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.87 35.22 1.42 Allowed 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 127.301 2.241 . . . . 0.0 114.822 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.35 -29.58 62.75 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.009 -1.057 . . . . 0.0 113.772 -175.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -146.72 0.38 0.76 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.564 1.146 . . . . 0.0 113.789 178.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.36 -33.87 70.04 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.309 1.044 . . . . 0.0 113.203 -177.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -89.66 -64.63 1.11 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.785 0.834 . . . . 0.0 110.852 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -73.67 -47.49 39.42 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.715 1.206 . . . . 0.0 114.024 -168.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -81.69 -29.66 32.94 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.564 0.746 . . . . 0.0 111.283 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.23 -44.68 89.08 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.058 0.837 . . . . 0.0 112.792 167.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.84 -47.06 82.29 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.031 0.915 . . . . 0.0 112.623 173.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -65.33 -17.2 64.33 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 177.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -115.87 -15.38 11.26 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 172.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 71.8 t-105 -66.44 -51.65 54.63 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.312 0.96 . . . . 0.0 111.179 162.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 82.8 p -62.87 -19.48 64.2 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.59 -13.72 59.63 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 172.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.98 -18.05 0.18 Allowed Glycine 0 CA--C 1.535 1.308 0 CA-C-O 117.724 -1.598 . . . . 0.0 116.11 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 60.96 21.85 12.11 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.43 1.492 . . . . 0.0 113.528 -164.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.97 31.92 2.61 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 125.968 1.707 . . . . 0.0 113.709 -170.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -93.78 -8.83 39.48 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.786 2.035 . . . . 0.0 113.084 -174.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.46 26.52 6.49 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.51 1.052 . . . . 0.0 113.325 -176.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.295 8.2 p 44.39 74.19 0.83 Allowed Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 127.45 2.3 . . . . 0.0 113.604 -177.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -41.91 -42.03 6.6 Favored 'Trans proline' 0 C--N 1.354 0.848 1 C-N-CA 125.375 4.05 . . . . 0.0 117.592 -171.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.585 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.1 -9.24 37.47 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 177.511 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 61.0 m -133.47 -0.64 3.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.929 2.092 . . . . 0.0 113.736 176.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -54.44 138.52 59.49 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 126.116 1.766 . . . . 0.0 111.256 174.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -46.17 -41.1 21.83 Favored 'Trans proline' 0 CA--C 1.547 1.172 0 C-N-CA 123.696 2.931 . . . . 0.0 117.967 -176.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -61.97 -22.61 74.61 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 123.328 2.685 . . . . 0.0 115.078 175.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -96.42 -10.58 27.25 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.764 1.226 . . . . 0.0 112.954 172.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.2 40.76 5.28 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.738 2.015 . . . . 0.0 115.317 176.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.1 mp 58.75 16.9 4.74 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.442 1.897 . . . . 0.0 114.703 -177.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.355 0 O-C-N 119.36 -2.088 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.703 0.287 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.585 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.8 t70 -134.47 -48.69 0.03 OUTLIER Pre-proline 0 CA--C 1.548 0.895 0 CA-C-O 117.319 -1.324 . . . . 0.0 113.461 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.585 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 57.9 Cg_endo -72.59 -36.45 5.01 Favored 'Trans proline' 0 C--N 1.356 0.922 0 CA-C-N 121.872 1.704 . . . . 0.0 112.984 175.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.24 38.01 3.13 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 127.361 2.264 . . . . 0.0 114.911 174.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 99.0 mt -74.57 -27.7 60.61 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -175.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -147.46 -1.43 0.62 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.674 1.19 . . . . 0.0 113.837 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.32 -34.11 68.4 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.057 -1.027 . . . . 0.0 113.235 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 -99.19 -63.07 1.16 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.349 1.059 . . . . 0.0 110.952 171.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptm85 -71.1 -37.88 72.37 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 -167.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -93.15 -30.15 15.38 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.209 1.004 . . . . 0.0 111.621 177.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.33 -44.3 76.0 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 123.757 0.694 . . . . 0.0 112.606 166.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.93 -46.88 87.38 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 117.966 0.883 . . . . 0.0 113.042 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -65.77 -14.09 60.68 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -119.31 -14.1 9.24 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -66.86 -49.08 66.81 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.8 1.182 . . . . 0.0 111.255 161.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 81.0 p -63.01 -15.68 57.25 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.29 -11.84 60.08 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 171.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.98 -20.1 0.06 OUTLIER Glycine 0 CA--C 1.533 1.189 0 CA-C-O 117.677 -1.624 . . . . 0.0 116.626 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 76.08 18.69 1.94 Allowed 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 127.689 2.395 . . . . 0.0 113.788 -167.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.09 44.97 19.5 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.139 1.376 . . . . 0.0 112.525 -170.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.3 tpt85 -123.93 17.06 9.35 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.934 2.494 . . . . 0.0 111.454 -165.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.68 22.06 62.68 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.452 1.025 . . . . 0.0 114.226 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.5 p 42.45 79.97 0.3 Allowed Pre-proline 0 N--CA 1.481 1.098 0 C-N-CA 127.055 2.142 . . . . 0.0 113.592 -174.311 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -40.6 -44.93 4.58 Favored 'Trans proline' 0 C--N 1.355 0.872 1 C-N-CA 125.659 4.24 . . . . 0.0 117.865 -169.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.606 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.0 -8.49 23.25 Favored 'General case' 0 CA--C 1.551 1.005 0 N-CA-C 115.705 1.742 . . . . 0.0 115.705 177.83 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.5 m -134.0 11.19 3.93 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 127.002 2.121 . . . . 0.0 113.017 176.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -65.89 141.01 97.43 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.401 1.081 . . . . 0.0 110.484 176.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -50.26 -40.05 52.35 Favored 'Trans proline' 0 CA--C 1.549 1.242 0 C-N-CA 122.713 2.275 . . . . 0.0 116.138 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -58.61 -20.39 49.95 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 124.258 3.305 . . . . 0.0 116.174 171.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -104.06 -3.95 23.89 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.377 1.471 . . . . 0.0 112.802 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.14 38.77 3.47 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.09 2.156 . . . . 0.0 115.286 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.8 mp 58.67 18.32 5.8 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.475 1.91 . . . . 0.0 114.195 -177.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.347 0 O-C-N 119.372 -2.08 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 110.505 -0.183 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -66.96 -48.07 51.58 Favored Pre-proline 0 CA--C 1.554 1.098 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 175.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.88 -35.85 1.3 Allowed 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 121.865 1.71 . . . . 0.0 113.496 -178.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 45.81 35.15 2.13 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 127.16 2.184 . . . . 0.0 114.886 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.4 mt -74.29 -27.39 60.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 -175.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -147.86 -4.55 0.49 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.81 -33.23 70.13 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.112 -0.992 . . . . 0.0 113.501 -176.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.2 mtm180 -87.51 -65.07 1.05 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.732 0.813 . . . . 0.0 110.749 172.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -73.2 -49.85 25.74 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.96 1.304 . . . . 0.0 114.014 -168.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -80.47 -30.05 37.46 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.75 0.82 . . . . 0.0 111.259 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.28 -44.4 89.37 Favored Glycine 0 CA--C 1.535 1.328 0 C-N-CA 123.896 0.76 . . . . 0.0 113.068 167.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.68 -46.84 80.69 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.164 0.982 . . . . 0.0 112.753 174.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -65.23 -14.72 61.34 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -118.52 -15.55 9.59 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 114.517 1.302 . . . . 0.0 114.517 172.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.3 t-105 -65.26 -50.6 65.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.588 1.085 . . . . 0.0 111.091 161.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.4 p -62.28 -20.52 64.38 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.04 -12.28 59.46 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 173.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -143.61 -20.39 0.2 Allowed Glycine 0 CA--C 1.536 1.355 0 CA-C-O 117.942 -1.476 . . . . 0.0 115.818 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 65.18 21.26 12.1 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.971 1.709 . . . . 0.0 113.842 -168.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.48 42.33 14.31 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.442 1.497 . . . . 0.0 112.879 -171.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.1 tpt85 -122.73 15.93 10.22 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.355 2.262 . . . . 0.0 111.68 -168.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.6 26.51 42.33 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 124.4 1.0 . . . . 0.0 114.238 174.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.6 p 43.46 74.29 0.8 Allowed Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.702 2.001 . . . . 0.0 113.205 -176.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -41.36 -43.5 5.65 Favored 'Trans proline' 0 C--N 1.354 0.841 1 C-N-CA 125.453 4.102 . . . . 0.0 117.727 -169.003 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.589 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.96 -9.54 22.25 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 178.093 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -133.2 5.65 3.82 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 126.577 1.951 . . . . 0.0 113.267 176.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -65.03 138.67 97.52 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.767 1.227 . . . . 0.0 110.608 174.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -47.61 -40.12 30.18 Favored 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 123.377 2.718 . . . . 0.0 117.653 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.02 -20.51 69.88 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.344 2.696 . . . . 0.0 115.23 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -99.02 -2.41 37.3 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.02 1.328 . . . . 0.0 112.707 172.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.71 37.66 3.54 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.08 2.152 . . . . 0.0 115.46 176.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp 58.34 19.34 6.27 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 126.422 1.889 . . . . 0.0 114.045 -177.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 O-C-N 119.489 -2.007 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 120.452 0.168 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.58 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 28.2 t70 -129.34 -47.28 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 125.334 1.454 . . . . 0.0 114.118 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.58 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 61.3 Cg_endo -73.35 -34.01 6.43 Favored 'Trans proline' 0 C--N 1.355 0.917 0 CA-C-N 122.037 1.763 . . . . 0.0 112.904 175.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 45.7 35.54 2.23 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 127.476 2.311 . . . . 0.0 115.014 173.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.71 -32.21 69.34 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -175.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -147.94 1.07 0.65 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.46 -34.19 68.74 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.046 -1.034 . . . . 0.0 113.246 -176.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -92.26 -65.09 1.03 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.832 0.853 . . . . 0.0 110.788 172.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -68.53 -49.41 59.78 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.783 1.233 . . . . 0.0 113.652 -168.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -83.36 -30.77 27.16 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.745 0.818 . . . . 0.0 111.365 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.46 -44.88 85.34 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.138 0.875 . . . . 0.0 113.011 169.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.36 -46.78 78.79 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.037 0.919 . . . . 0.0 112.83 174.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -64.71 -18.1 64.71 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 176.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -115.35 -13.14 11.68 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 173.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.4 t-105 -67.1 -53.23 32.77 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.451 1.023 . . . . 0.0 111.125 159.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.0 p -63.43 -18.82 64.13 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.76 -16.47 57.93 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.679 1.191 . . . . 0.0 114.126 171.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.98 -20.26 0.38 Allowed Glycine 0 CA--C 1.536 1.359 0 CA-C-O 118.15 -1.361 . . . . 0.0 115.335 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 70.68 20.74 5.58 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.66 1.984 . . . . 0.0 113.764 -166.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.76 42.99 16.54 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.392 1.477 . . . . 0.0 112.808 -172.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.8 tpt85 -120.61 8.8 10.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.77 2.428 . . . . 0.0 111.844 -166.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.52 21.95 59.27 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.581 1.086 . . . . 0.0 113.913 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.294 7.5 p 42.63 77.95 0.41 Allowed Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 127.121 2.168 . . . . 0.0 113.545 -177.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -39.87 -43.84 3.46 Favored 'Trans proline' 0 C--N 1.356 0.923 1 C-N-CA 125.954 4.436 . . . . 0.0 118.128 -166.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.615 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.92 -9.4 20.99 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.715 1.746 . . . . 0.0 115.715 178.293 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.3 m -134.75 7.48 3.51 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.677 1.991 . . . . 0.0 113.118 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -63.13 138.87 97.45 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.83 1.252 . . . . 0.0 111.011 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.45 -40.91 29.46 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 123.427 2.751 . . . . 0.0 117.526 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -63.45 -22.32 71.24 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.237 2.625 . . . . 0.0 115.1 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -95.95 -10.86 27.61 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.734 1.214 . . . . 0.0 112.863 172.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.08 42.54 6.68 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.879 2.071 . . . . 0.0 115.018 177.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.1 mp 61.13 14.78 5.73 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.576 1.951 . . . . 0.0 114.376 -178.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.343 0 O-C-N 119.31 -2.119 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.1 mmt180 . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -68.74 -47.56 32.69 Favored Pre-proline 0 CA--C 1.553 1.08 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 173.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.76 -36.9 1.38 Allowed 'Trans proline' 0 C--N 1.357 1.008 0 CA-C-N 121.868 1.703 . . . . 0.0 113.299 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 44.68 35.6 1.48 Allowed 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 127.429 2.292 . . . . 0.0 115.149 176.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -70.72 -32.48 69.68 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -148.08 1.9 0.66 Allowed 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 178.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.51 -33.68 68.29 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.207 1.003 . . . . 0.0 113.293 -177.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.9 mtm180 -93.58 -63.84 1.16 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.836 0.854 . . . . 0.0 110.965 172.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -68.75 -50.69 48.48 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.453 1.101 . . . . 0.0 113.669 -169.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -81.43 -31.12 33.27 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.705 0.802 . . . . 0.0 111.386 177.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.45 -43.7 90.28 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 123.996 0.808 . . . . 0.0 113.239 169.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.75 -45.66 77.85 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.219 1.01 . . . . 0.0 112.782 174.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -65.29 -15.29 62.36 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -117.77 -13.3 10.16 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 65.5 t-105 -65.37 -52.27 54.73 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.574 1.079 . . . . 0.0 110.911 158.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.1 p -62.66 -20.34 64.72 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.87 -14.87 56.84 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.05 -22.7 0.44 Allowed Glycine 0 CA--C 1.535 1.285 0 CA-C-O 118.198 -1.335 . . . . 0.0 115.089 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 70.4 21.8 5.52 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.571 1.948 . . . . 0.0 113.935 -167.338 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.79 43.44 17.04 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.328 1.451 . . . . 0.0 112.708 -172.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -120.83 13.42 11.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.763 2.425 . . . . 0.0 111.501 -166.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.3 25.24 48.66 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.344 0.973 . . . . 0.0 114.015 177.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.276 7.4 p 44.25 76.47 0.53 Allowed Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.705 2.002 . . . . 0.0 113.326 -177.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -41.82 -43.49 6.73 Favored 'Trans proline' 0 C--N 1.354 0.816 1 C-N-CA 125.31 4.007 . . . . 0.0 117.501 -170.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.591 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.25 -7.93 27.92 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 178.219 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.9 m -132.37 4.47 4.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.661 1.985 . . . . 0.0 113.31 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -65.18 138.65 97.34 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.986 1.314 . . . . 0.0 111.029 178.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -47.85 -41.01 32.46 Favored 'Trans proline' 0 CA--C 1.548 1.206 0 C-N-CA 123.488 2.792 . . . . 0.0 117.475 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.64 -20.8 71.9 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.342 2.695 . . . . 0.0 115.052 175.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -97.13 -3.15 41.64 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.918 1.287 . . . . 0.0 112.806 172.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 46.01 38.43 4.67 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.727 2.011 . . . . 0.0 115.028 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp 54.97 21.34 3.66 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.393 1.877 . . . . 0.0 115.022 -174.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 O-C-N 119.577 -1.952 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 110.811 -0.07 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -68.35 -48.06 36.1 Favored Pre-proline 0 CA--C 1.554 1.105 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 172.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -76.48 -42.2 0.38 Allowed 'Trans proline' 0 C--N 1.357 0.993 0 CA-C-N 121.924 1.723 . . . . 0.0 113.364 -178.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.74 33.93 1.07 Allowed 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 127.271 2.229 . . . . 0.0 114.907 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.4 mt -72.57 -31.02 64.91 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.985 -1.072 . . . . 0.0 113.601 -176.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -147.55 3.15 0.75 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.509 1.124 . . . . 0.0 113.891 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.83 -33.83 69.04 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.029 -1.044 . . . . 0.0 113.269 -176.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.9 mtm180 -91.63 -66.15 0.95 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.769 0.828 . . . . 0.0 110.813 172.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -67.23 -52.15 44.54 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.188 1.395 . . . . 0.0 113.792 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -80.94 -29.64 35.39 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.595 0.758 . . . . 0.0 111.48 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.9 -42.36 86.11 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.06 0.838 . . . . 0.0 113.209 168.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.37 68.63 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.014 0.907 . . . . 0.0 112.927 173.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.93 -18.88 64.67 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.863 1.265 . . . . 0.0 114.368 175.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -112.66 -14.91 13.09 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 172.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -65.55 -52.68 50.63 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 119.41 1.004 . . . . 0.0 111.14 161.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.2 p -63.19 -20.83 65.77 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.65 -16.05 62.21 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 173.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -136.69 -18.97 0.67 Allowed Glycine 0 CA--C 1.536 1.347 0 CA-C-O 118.327 -1.263 . . . . 0.0 115.064 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 79.62 18.64 0.72 Allowed 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 127.89 2.476 . . . . 0.0 113.659 -167.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.14 45.69 19.66 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.117 1.367 . . . . 0.0 112.355 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.9 tpt85 -122.07 14.36 10.62 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.788 2.435 . . . . 0.0 111.657 -163.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.65 21.6 71.66 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-O 118.701 -1.055 . . . . 0.0 113.734 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.287 6.7 p 42.01 81.58 0.24 Allowed Pre-proline 0 N--CA 1.48 1.04 0 C-N-CA 127.406 2.283 . . . . 0.0 113.688 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -41.27 -43.43 5.43 Favored 'Trans proline' 0 C--N 1.354 0.839 1 C-N-CA 125.623 4.215 . . . . 0.0 118.085 -166.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.636 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.64 -7.74 22.61 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 178.306 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.5 m -127.95 -3.53 5.79 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.476 1.91 . . . . 0.0 113.4 175.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -62.2 137.28 95.79 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.18 1.392 . . . . 0.0 111.044 175.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.02 -39.64 33.07 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.481 2.787 . . . . 0.0 117.662 -178.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -61.61 -17.3 53.55 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.488 2.792 . . . . 0.0 115.516 174.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -107.25 2.27 24.53 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.395 1.478 . . . . 0.0 112.709 172.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 42.76 47.13 4.64 Favored 'General case' 0 CA--C 1.55 0.981 0 C-N-CA 127.353 2.261 . . . . 0.0 115.881 172.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 18.8 mt 57.92 18.76 5.25 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.808 1.643 . . . . 0.0 114.69 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 O-C-N 119.596 -1.94 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.56 0.219 . . . . 0.0 111.37 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.576 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 28.2 t70 -130.83 -47.9 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.983 0 C-N-CA 125.26 1.424 . . . . 0.0 114.138 -178.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.576 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 60.1 Cg_endo -73.2 -33.96 6.7 Favored 'Trans proline' 0 C--N 1.357 0.988 0 CA-C-N 122.211 1.825 . . . . 0.0 113.028 175.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.75 30.13 1.75 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.415 2.286 . . . . 0.0 115.355 175.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.15 -33.99 74.29 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.011 -1.056 . . . . 0.0 113.724 -175.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -149.04 2.17 0.57 Allowed 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.28 -36.37 68.53 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.415 1.086 . . . . 0.0 113.307 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.0 mtm180 -97.72 -62.89 1.18 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.141 0.976 . . . . 0.0 111.029 171.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -69.35 -40.86 77.25 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -168.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -91.3 -29.15 17.31 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.146 0.979 . . . . 0.0 111.418 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.52 -42.99 77.63 Favored Glycine 0 CA--C 1.538 1.483 0 C-N-CA 123.908 0.766 . . . . 0.0 112.946 167.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.23 -47.01 81.29 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 117.987 0.894 . . . . 0.0 113.083 174.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -65.57 -15.68 62.95 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.436 1.272 . . . . 0.0 114.436 176.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -115.8 -14.4 11.36 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 172.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -65.99 -51.95 53.83 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.529 1.059 . . . . 0.0 111.087 160.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.2 p -62.85 -19.0 63.7 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.83 -15.23 58.32 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.29 1.219 . . . . 0.0 114.29 172.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.04 -22.39 0.38 Allowed Glycine 0 CA--C 1.535 1.313 0 CA-C-O 118.291 -1.283 . . . . 0.0 115.211 177.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 74.24 20.06 2.74 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 127.104 2.162 . . . . 0.0 113.812 -167.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.77 44.17 17.6 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.173 1.389 . . . . 0.0 112.522 -171.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.6 tpt85 -121.68 12.83 10.72 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 127.724 2.41 . . . . 0.0 111.662 -165.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.46 22.82 57.88 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.576 1.084 . . . . 0.0 114.056 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.286 7.3 p 43.34 77.32 0.45 Allowed Pre-proline 0 N--CA 1.479 1.018 0 C-N-CA 126.866 2.067 . . . . 0.0 113.392 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -40.57 -43.57 4.29 Favored 'Trans proline' 0 C--N 1.355 0.881 1 C-N-CA 125.61 4.207 . . . . 0.0 117.985 -167.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.592 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.73 -9.48 20.44 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 178.03 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.3 m -134.08 6.14 3.61 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.688 1.995 . . . . 0.0 113.26 176.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -64.09 139.43 97.68 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 124.747 1.219 . . . . 0.0 110.704 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.19 -40.55 27.36 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 123.456 2.771 . . . . 0.0 117.623 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -62.34 -21.74 73.09 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.35 2.7 . . . . 0.0 115.194 174.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -98.44 -7.4 28.67 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.939 1.296 . . . . 0.0 112.782 172.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.79 40.92 4.62 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.028 2.131 . . . . 0.0 115.321 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.5 mp 59.95 16.75 6.03 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 126.468 1.907 . . . . 0.0 114.225 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.308 0 O-C-N 119.358 -2.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 110.826 -0.064 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -74.01 -47.67 6.36 Favored Pre-proline 0 CA--C 1.553 1.091 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 174.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.66 -32.73 2.64 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 121.915 1.743 . . . . 0.0 113.526 -176.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.95 31.56 2.42 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 127.257 2.223 . . . . 0.0 115.583 174.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.35 -34.74 75.04 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -173.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -148.44 0.78 0.6 Allowed 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.98 -34.98 70.55 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.39 1.076 . . . . 0.0 113.504 -176.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -91.49 -63.47 1.25 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.991 0.917 . . . . 0.0 111.013 172.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -73.25 -46.81 47.85 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.946 1.298 . . . . 0.0 114.044 -168.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -82.05 -27.64 32.9 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.597 0.759 . . . . 0.0 111.243 175.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.23 -43.31 84.09 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 123.977 0.799 . . . . 0.0 113.172 166.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.75 -44.98 80.04 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.142 0.971 . . . . 0.0 113.103 174.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -63.95 -15.36 59.01 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.036 1.334 . . . . 0.0 114.494 176.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -117.87 -10.84 10.37 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 172.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -68.0 -51.45 47.04 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.649 1.113 . . . . 0.0 111.065 158.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.8 p -63.18 -16.13 59.13 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.99 -13.73 58.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 171.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.14 -22.1 0.07 OUTLIER Glycine 0 CA--C 1.535 1.287 0 CA-C-O 117.929 -1.484 . . . . 0.0 116.122 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 69.21 20.65 7.46 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 126.765 2.026 . . . . 0.0 113.794 -166.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.47 42.85 15.08 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.32 1.448 . . . . 0.0 112.785 -171.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.8 tpt85 -116.79 12.73 14.91 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.626 2.371 . . . . 0.0 111.732 -167.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.87 20.91 60.34 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 124.588 1.09 . . . . 0.0 113.937 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.4 p 41.61 77.89 0.41 Allowed Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 126.989 2.115 . . . . 0.0 113.245 -175.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -41.17 -41.26 4.52 Favored 'Trans proline' 0 C--N 1.354 0.863 1 C-N-CA 125.883 4.389 . . . . 0.0 118.496 -165.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.585 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.29 -9.61 18.64 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 176.808 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 65.3 m -133.57 14.05 4.08 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.108 2.163 . . . . 0.0 112.917 177.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.58 140.35 96.45 Favored Pre-proline 0 CA--C 1.551 1.015 0 O-C-N 120.896 -1.128 . . . . 0.0 111.224 177.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -51.82 -39.97 66.89 Favored 'Trans proline' 0 CA--C 1.549 1.227 0 C-N-CA 122.941 2.427 . . . . 0.0 116.193 174.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -60.36 -21.63 68.04 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.484 2.79 . . . . 0.0 115.618 172.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -95.72 0.76 52.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.885 1.274 . . . . 0.0 112.629 171.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 47.03 33.95 2.56 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.909 2.084 . . . . 0.0 114.803 -177.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.3 mp 56.48 21.36 5.54 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.477 1.911 . . . . 0.0 114.008 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 O-C-N 119.481 -2.012 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 110.727 -0.101 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -70.57 -49.39 15.72 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 173.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -79.8 -34.89 0.84 Allowed 'Trans proline' 0 C--N 1.357 0.976 0 CA-C-N 121.874 1.705 . . . . 0.0 113.684 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 43.32 37.95 1.52 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 127.295 2.238 . . . . 0.0 113.982 -176.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.6 -39.3 77.35 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.494 1.118 . . . . 0.0 112.562 -171.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -143.99 2.67 1.19 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.812 1.245 . . . . 0.0 113.534 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.58 -32.85 69.33 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 120.969 -1.082 . . . . 0.0 113.414 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 -88.29 -66.75 0.88 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.789 0.836 . . . . 0.0 110.756 172.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -69.64 -53.7 17.46 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.223 1.409 . . . . 0.0 113.801 -169.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -77.44 -31.14 53.68 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.645 0.778 . . . . 0.0 111.427 177.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -57.2 -42.76 93.52 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.141 0.877 . . . . 0.0 113.364 169.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.78 -46.9 73.82 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.183 0.992 . . . . 0.0 112.776 173.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -64.52 -17.52 63.98 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 175.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -113.54 -13.31 12.79 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 172.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.8 t-105 -67.49 -51.8 46.85 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.475 1.034 . . . . 0.0 111.192 160.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.6 p -63.51 -17.9 63.25 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.422 1.268 . . . . 0.0 114.422 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.85 -16.17 57.45 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.681 1.192 . . . . 0.0 114.192 171.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -136.71 -24.17 0.48 Allowed Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.862 1.22 . . . . 0.0 114.85 175.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 73.0 18.66 3.89 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.986 2.114 . . . . 0.0 113.823 -165.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.63 43.66 16.6 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.242 1.417 . . . . 0.0 112.581 -170.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -117.57 10.47 13.48 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 127.502 2.321 . . . . 0.0 112.086 -165.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.96 21.52 65.52 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 118.805 -0.997 . . . . 0.0 113.676 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.288 7.2 p 40.16 78.54 0.36 Allowed Pre-proline 0 N--CA 1.48 1.05 0 C-N-CA 127.3 2.24 . . . . 0.0 113.513 -177.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -40.1 -41.86 3.24 Favored 'Trans proline' 0 C--N 1.355 0.897 1 C-N-CA 126.091 4.527 . . . . 0.0 118.71 -164.124 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.613 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.52 -9.33 12.55 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 177.283 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.9 m -129.32 9.17 5.59 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.517 1.927 . . . . 0.0 113.004 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -70.49 140.04 87.03 Favored Pre-proline 0 CA--C 1.551 0.992 0 O-C-N 120.94 -1.1 . . . . 0.0 111.301 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -51.3 -39.79 62.32 Favored 'Trans proline' 0 CA--C 1.548 1.207 0 C-N-CA 123.177 2.585 . . . . 0.0 116.511 175.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -60.07 -20.38 60.68 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.548 2.832 . . . . 0.0 115.709 172.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.16 2.16 42.73 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.045 1.338 . . . . 0.0 112.575 172.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 46.29 37.06 3.74 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.721 2.009 . . . . 0.0 114.653 -178.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.2 mp 57.81 20.64 6.72 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.413 1.885 . . . . 0.0 114.104 -176.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 O-C-N 119.33 -2.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 120.44 0.162 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.468 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.7 t70 -113.23 -48.15 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.085 1.354 . . . . 0.0 113.65 176.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 69.7 Cg_endo -75.7 -36.39 2.18 Favored 'Trans proline' 0 C--N 1.357 0.98 0 CA-C-N 122.049 1.767 . . . . 0.0 113.112 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 43.01 37.97 1.29 Allowed 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 127.544 2.337 . . . . 0.0 114.713 178.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 98.2 mt -70.91 -32.45 69.38 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -148.63 3.29 0.64 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.35 -34.15 68.51 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.025 -1.047 . . . . 0.0 113.195 -176.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 -91.99 -65.01 1.04 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.782 0.833 . . . . 0.0 111.033 171.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -68.69 -48.06 64.86 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.875 1.27 . . . . 0.0 114.153 -169.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -83.77 -29.53 27.35 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.803 0.841 . . . . 0.0 111.408 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.57 -41.93 89.72 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 123.999 0.809 . . . . 0.0 113.172 168.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.58 -45.68 78.46 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.142 0.971 . . . . 0.0 112.834 173.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.62 -17.28 63.87 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 175.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -114.17 -11.55 12.64 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 172.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -68.4 -53.49 23.47 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.48 1.036 . . . . 0.0 110.995 158.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.9 p -63.63 -17.62 63.09 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.37 -16.37 54.18 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.325 1.232 . . . . 0.0 114.325 171.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.87 -18.78 0.18 Allowed Glycine 0 CA--C 1.535 1.288 0 CA-C-O 118.034 -1.426 . . . . 0.0 115.671 178.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 81.06 18.43 0.48 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 128.185 2.594 . . . . 0.0 113.575 -167.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.26 45.12 20.14 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.98 1.312 . . . . 0.0 112.44 -170.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -121.85 12.81 10.59 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 127.938 2.495 . . . . 0.0 111.736 -164.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.6 20.53 68.56 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.519 1.057 . . . . 0.0 114.003 -178.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.292 7.6 p 43.35 80.1 0.3 Allowed Pre-proline 0 N--CA 1.48 1.031 0 C-N-CA 127.167 2.187 . . . . 0.0 113.499 -176.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -41.04 -43.74 4.96 Favored 'Trans proline' 0 C--N 1.355 0.898 1 C-N-CA 125.721 4.281 . . . . 0.0 117.882 -167.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.602 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.53 -7.48 20.25 Favored 'General case' 0 CA--C 1.551 1.018 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 178.497 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.1 m -130.73 -3.24 4.16 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.475 1.91 . . . . 0.0 113.513 175.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.17 138.77 91.48 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 125.69 1.596 . . . . 0.0 111.498 178.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -46.93 -38.93 24.31 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 123.598 2.865 . . . . 0.0 117.997 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -63.17 -20.66 71.47 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.365 2.71 . . . . 0.0 115.171 173.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -103.44 -13.29 16.68 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.147 1.379 . . . . 0.0 112.888 172.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.37 51.43 7.68 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 127.103 2.161 . . . . 0.0 115.039 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 32.9 mt 61.15 12.62 4.18 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 126.36 1.864 . . . . 0.0 114.899 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 O-C-N 119.538 -1.977 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 120.896 0.379 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.563 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.9 t70 -131.89 -48.43 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.309 1.444 . . . . 0.0 113.93 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.563 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 57.1 Cg_endo -72.95 -38.47 2.89 Favored 'Trans proline' 0 C--N 1.356 0.923 0 CA-C-N 122.137 1.799 . . . . 0.0 112.801 174.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.58 36.22 2.46 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 127.309 2.244 . . . . 0.0 114.645 176.172 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.9 mt -76.4 -24.35 54.05 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -176.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -147.36 -1.62 0.62 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.28 -33.36 69.34 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.028 -1.045 . . . . 0.0 113.413 -177.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -92.27 -65.01 1.04 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.912 0.885 . . . . 0.0 110.975 171.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -71.38 -34.57 70.54 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -168.155 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -99.27 -27.36 13.82 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.474 1.109 . . . . 0.0 111.337 176.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.4 -40.02 75.32 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.753 0.692 . . . . 0.0 112.894 164.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.53 -46.19 87.17 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.083 0.941 . . . . 0.0 112.933 172.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -65.69 -11.62 46.7 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.966 1.306 . . . . 0.0 114.334 174.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -120.63 -11.72 9.01 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 70.8 t-105 -65.3 -50.17 66.71 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.664 1.12 . . . . 0.0 110.91 159.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.5 p -62.03 -16.63 53.23 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.19 -13.9 61.01 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 171.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.06 -16.53 0.1 OUTLIER Glycine 0 CA--C 1.536 1.394 0 CA-C-O 117.874 -1.514 . . . . 0.0 116.14 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 75.01 18.62 2.5 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 127.323 2.249 . . . . 0.0 113.958 -166.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.78 45.21 18.37 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.392 1.477 . . . . 0.0 112.385 -171.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 tpt85 -124.93 15.06 8.56 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 127.963 2.505 . . . . 0.0 111.638 -163.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.3 16.83 68.13 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.724 1.154 . . . . 0.0 114.195 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.303 6.8 p 44.81 80.08 0.31 Allowed Pre-proline 0 N--CA 1.479 1.013 0 C-N-CA 127.07 2.148 . . . . 0.0 113.124 -173.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -41.72 -43.39 6.49 Favored 'Trans proline' 0 C--N 1.356 0.921 1 C-N-CA 125.553 4.169 . . . . 0.0 118.125 -169.223 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.619 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.59 -6.56 20.73 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 177.754 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.4 m -133.06 12.58 4.28 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.968 2.107 . . . . 0.0 112.956 176.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -68.66 141.1 92.47 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.829 1.251 . . . . 0.0 111.1 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -52.84 -40.37 75.13 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 123.237 2.625 . . . . 0.0 115.222 172.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -56.85 -19.21 30.57 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.937 3.091 . . . . 0.0 116.463 169.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -106.47 2.83 26.63 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.155 1.382 . . . . 0.0 112.829 173.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.64 47.19 8.62 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.775 2.03 . . . . 0.0 114.676 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.9 mt 62.3 14.04 6.45 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 126.462 1.905 . . . . 0.0 114.894 -177.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.347 0 O-C-N 119.49 -2.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.547 0.213 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.541 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.0 t70 -129.56 -48.95 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.201 1.4 . . . . 0.0 113.733 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.541 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.0 Cg_endo -73.4 -38.71 2.42 Favored 'Trans proline' 0 C--N 1.357 1.011 0 CA-C-N 122.034 1.762 . . . . 0.0 112.745 174.255 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.72 34.69 1.87 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 127.294 2.238 . . . . 0.0 114.669 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.4 mt -76.25 -26.22 55.77 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -147.49 0.62 0.69 Allowed 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 -177.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.24 -37.21 69.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.364 1.065 . . . . 0.0 113.212 -177.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -95.3 -62.82 1.24 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.759 0.824 . . . . 0.0 111.095 169.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -71.23 -30.35 66.24 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 -167.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -102.81 -28.8 11.85 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.799 1.24 . . . . 0.0 111.333 174.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.3 -41.97 81.21 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.741 0.686 . . . . 0.0 112.948 166.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.55 -44.95 96.12 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.06 0.93 . . . . 0.0 113.021 174.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -66.64 -13.5 61.25 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 176.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -117.77 -13.69 10.15 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 171.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -66.71 -50.03 64.13 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.668 1.122 . . . . 0.0 110.924 159.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.5 p -63.93 -13.74 48.09 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.3 -12.14 59.36 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 170.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.97 -23.89 0.06 OUTLIER Glycine 0 CA--C 1.535 1.302 0 CA-C-O 117.786 -1.563 . . . . 0.0 116.16 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 67.68 22.03 9.12 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.396 1.879 . . . . 0.0 113.718 -167.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.18 42.01 16.68 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.437 1.495 . . . . 0.0 113.043 -172.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.2 tpt85 -120.29 8.49 10.86 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.509 2.324 . . . . 0.0 112.102 -168.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.6 20.83 53.24 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.774 1.178 . . . . 0.0 114.212 176.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.296 7.2 p 43.5 77.68 0.43 Allowed Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 126.82 2.048 . . . . 0.0 113.441 -174.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -41.18 -42.82 5.1 Favored 'Trans proline' 0 C--N 1.355 0.91 1 C-N-CA 125.724 4.283 . . . . 0.0 118.051 -168.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.58 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -65.25 -9.48 24.28 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 177.957 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.9 m -134.09 11.96 3.91 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.659 1.984 . . . . 0.0 112.91 176.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -64.37 140.82 98.05 Favored Pre-proline 0 CA--C 1.548 0.881 0 O-C-N 120.885 -1.134 . . . . 0.0 111.089 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -53.15 -41.51 71.57 Favored 'Trans proline' 0 CA--C 1.55 1.322 0 C-N-CA 122.424 2.083 . . . . 0.0 115.482 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -54.83 -22.22 28.91 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 124.222 3.281 . . . . 0.0 116.764 169.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -100.19 -6.17 26.53 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.572 1.149 . . . . 0.0 113.114 173.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.87 45.48 8.51 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.359 1.864 . . . . 0.0 114.595 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.2 mt 64.05 11.08 5.88 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 126.859 2.063 . . . . 0.0 115.16 -177.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.395 0 O-C-N 119.523 -1.986 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 120.625 0.25 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.527 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.4 t70 -135.45 -49.86 0.02 OUTLIER Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.086 1.355 . . . . 0.0 113.684 178.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.527 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 59.7 Cg_endo -73.58 -34.2 5.91 Favored 'Trans proline' 0 C--N 1.358 1.034 0 CA-C-N 121.975 1.741 . . . . 0.0 113.035 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 43.54 38.35 1.83 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 127.508 2.323 . . . . 0.0 114.195 178.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.85 -30.67 62.8 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.272 1.029 . . . . 0.0 113.23 -173.666 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -145.54 -0.77 0.83 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.92 -33.54 68.9 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.029 -1.045 . . . . 0.0 113.365 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.7 mtm180 -89.43 -63.78 1.24 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.563 0.745 . . . . 0.0 110.902 170.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -72.08 -43.84 64.21 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.267 1.427 . . . . 0.0 114.568 -169.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -88.22 -27.05 22.05 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.998 0.919 . . . . 0.0 111.48 175.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.24 -43.0 89.31 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 123.612 0.625 . . . . 0.0 112.76 165.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.17 -44.21 92.77 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.048 0.924 . . . . 0.0 112.988 173.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.97 -15.52 62.32 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -119.7 -15.43 8.93 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 172.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -67.05 -50.38 62.1 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.387 0.994 . . . . 0.0 111.125 162.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.1 p -63.32 -19.59 64.74 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.9 -14.14 58.85 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 172.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -140.32 -20.23 0.36 Allowed Glycine 0 CA--C 1.535 1.318 0 CA-C-O 118.008 -1.44 . . . . 0.0 115.377 178.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 76.41 21.99 1.32 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 127.355 2.262 . . . . 0.0 113.675 -167.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.34 43.52 19.34 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.152 1.381 . . . . 0.0 112.649 -172.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -122.54 9.61 9.65 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.84 2.456 . . . . 0.0 111.887 -164.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.44 21.76 53.22 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.592 1.091 . . . . 0.0 114.233 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.294 7.1 p 43.83 76.01 0.58 Allowed Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 126.804 2.042 . . . . 0.0 113.235 -176.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -40.72 -43.21 4.42 Favored 'Trans proline' 0 C--N 1.355 0.877 1 C-N-CA 125.763 4.309 . . . . 0.0 117.974 -167.268 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.605 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.03 -9.87 18.61 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.185 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.0 m -131.81 3.29 4.11 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.3 1.84 . . . . 0.0 113.464 175.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -64.95 138.87 97.62 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 124.95 1.3 . . . . 0.0 111.17 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -47.63 -40.36 30.51 Favored 'Trans proline' 0 CA--C 1.548 1.213 0 C-N-CA 123.651 2.901 . . . . 0.0 117.705 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -61.65 -20.61 69.51 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.411 2.74 . . . . 0.0 115.202 174.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -99.52 -2.53 35.62 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.925 1.29 . . . . 0.0 112.776 172.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.81 38.69 4.55 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.755 2.022 . . . . 0.0 115.137 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.0 mp 58.12 18.98 5.66 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.337 1.855 . . . . 0.0 114.484 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 O-C-N 119.398 -2.063 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 120.6 0.238 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.533 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.0 t70 -128.41 -48.51 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.235 1.414 . . . . 0.0 113.816 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.533 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.7 Cg_endo -73.49 -38.84 2.29 Favored 'Trans proline' 0 C--N 1.356 0.921 0 CA-C-N 122.086 1.781 . . . . 0.0 112.71 174.544 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.43 34.92 1.71 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 127.315 2.246 . . . . 0.0 114.728 177.435 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.5 mt -75.56 -26.15 57.71 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.04 -1.037 . . . . 0.0 113.704 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -147.89 -0.93 0.6 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -178.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.86 -34.77 70.1 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.096 -1.002 . . . . 0.0 113.325 -176.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.2 mtm180 -91.11 -65.51 1.01 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.69 0.796 . . . . 0.0 110.834 170.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -69.82 -40.03 76.13 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.238 1.415 . . . . 0.0 114.538 -168.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -93.63 -29.59 15.38 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.393 1.077 . . . . 0.0 111.249 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.46 -41.33 80.47 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 123.876 0.75 . . . . 0.0 113.184 168.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.14 -48.11 79.85 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 118.072 0.936 . . . . 0.0 112.807 173.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -64.32 -13.85 52.56 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -121.75 -19.0 6.94 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 171.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -62.0 -47.58 84.15 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.624 1.102 . . . . 0.0 111.308 164.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.0 p -61.97 -24.96 67.33 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.14 -5.91 42.25 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -132.7 -26.81 0.62 Allowed Glycine 0 CA--C 1.535 1.333 0 C-N-CA 124.941 1.258 . . . . 0.0 114.558 177.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 63.44 25.81 14.66 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.396 1.478 . . . . 0.0 113.802 -169.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.44 40.72 15.48 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.667 1.587 . . . . 0.0 113.339 -173.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -113.12 11.96 18.99 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 127.167 2.187 . . . . 0.0 111.969 -171.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.96 26.02 35.85 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 118.911 -0.938 . . . . 0.0 113.921 175.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.283 8.8 p 43.63 72.95 1.04 Allowed Pre-proline 0 N--CA 1.48 1.028 0 C-N-CA 126.644 1.978 . . . . 0.0 113.359 -177.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -41.54 -41.81 5.62 Favored 'Trans proline' 0 C--N 1.355 0.881 1 C-N-CA 125.64 4.227 . . . . 0.0 117.9 -168.435 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.613 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.27 -10.1 21.62 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 115.666 1.728 . . . . 0.0 115.666 177.629 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.9 m -133.36 3.26 3.61 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.222 1.809 . . . . 0.0 113.666 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -61.86 138.75 95.57 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.02 1.328 . . . . 0.0 111.148 176.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -47.01 -40.86 26.22 Favored 'Trans proline' 0 CA--C 1.548 1.217 0 C-N-CA 123.64 2.893 . . . . 0.0 117.79 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.47 -21.14 72.39 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.24 2.626 . . . . 0.0 115.043 175.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -97.29 -6.63 33.98 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.859 1.263 . . . . 0.0 112.81 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.34 40.26 5.15 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 126.964 2.105 . . . . 0.0 115.104 177.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.1 mp 55.5 19.54 3.24 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 126.564 1.945 . . . . 0.0 115.007 -175.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 O-C-N 119.395 -2.066 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 120.588 0.233 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.54 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.4 t70 -132.19 -49.09 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.993 0 CA-C-O 117.208 -1.377 . . . . 0.0 113.845 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.54 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.2 Cg_endo -73.18 -38.25 2.86 Favored 'Trans proline' 0 C--N 1.357 0.997 0 CA-C-N 122.14 1.8 . . . . 0.0 112.729 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.45 33.31 1.89 Allowed 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 127.244 2.218 . . . . 0.0 114.799 175.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.3 mt -73.69 -28.2 61.62 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.074 -1.016 . . . . 0.0 113.563 -176.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -148.06 2.08 0.67 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.52 -36.21 68.93 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 121.118 -0.988 . . . . 0.0 113.182 -177.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 -91.89 -65.28 1.02 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.557 0.743 . . . . 0.0 110.86 170.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -66.77 -46.06 76.53 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.862 1.265 . . . . 0.0 114.205 -169.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -88.72 -30.16 19.29 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.128 0.971 . . . . 0.0 111.407 177.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.33 -42.67 89.26 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 123.889 0.757 . . . . 0.0 113.17 170.111 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.64 -46.27 83.22 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.074 0.937 . . . . 0.0 112.833 173.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -65.01 -16.61 63.64 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 176.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -116.27 -13.41 11.08 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 172.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -67.46 -52.01 44.48 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.489 1.041 . . . . 0.0 111.021 160.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.2 p -62.56 -19.22 63.46 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.45 -13.82 53.64 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 171.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -143.55 -21.46 0.19 Allowed Glycine 0 CA--C 1.535 1.289 0 CA-C-O 117.836 -1.536 . . . . 0.0 115.722 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 70.02 20.7 6.42 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.427 1.891 . . . . 0.0 113.524 -165.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.82 37.02 6.54 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.571 1.549 . . . . 0.0 113.106 -171.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 48.5 tpt85 -102.71 -13.62 17.0 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.514 2.326 . . . . 0.0 113.059 -169.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.74 21.29 8.75 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.947 1.261 . . . . 0.0 113.759 -175.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.299 7.7 p 44.86 80.23 0.3 Allowed Pre-proline 0 N--CA 1.48 1.055 0 C-N-CA 127.345 2.258 . . . . 0.0 113.783 -177.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -42.66 -42.33 8.5 Favored 'Trans proline' 0 C--N 1.354 0.862 1 C-N-CA 125.57 4.18 . . . . 0.0 117.961 -170.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.61 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.77 -5.94 18.71 Favored 'General case' 0 CA--C 1.551 1.018 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.621 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.4 m -134.33 12.26 3.84 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 127.221 2.208 . . . . 0.0 112.713 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -65.26 143.59 98.82 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 125.066 1.346 . . . . 0.0 111.931 -177.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.57 -39.6 74.75 Favored 'Trans proline' 0 CA--C 1.548 1.212 0 C-N-CA 123.041 2.494 . . . . 0.0 116.214 173.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -60.02 -20.54 61.14 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.668 2.912 . . . . 0.0 115.602 170.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -99.02 6.67 46.54 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.449 1.5 . . . . 0.0 112.321 171.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 48.46 32.63 3.44 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 127.202 2.201 . . . . 0.0 115.123 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.14 28.65 9.25 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 125.587 1.555 . . . . 0.0 113.597 -174.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.349 0 O-C-N 119.326 -2.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -68.13 -49.63 33.95 Favored Pre-proline 0 CA--C 1.554 1.108 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 175.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.48 -42.97 0.19 Allowed 'Trans proline' 0 C--N 1.356 0.948 0 CA-C-N 121.845 1.695 . . . . 0.0 113.461 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.2 32.86 1.58 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 126.968 2.107 . . . . 0.0 114.396 -176.098 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.6 mt -79.01 -22.51 45.38 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -177.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -146.57 -1.89 0.68 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.18 -35.21 69.31 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.338 1.055 . . . . 0.0 113.297 -177.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.7 mtm180 -96.18 -65.75 0.95 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.936 0.894 . . . . 0.0 110.969 169.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -68.89 -19.26 64.22 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -167.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -120.9 -33.56 3.73 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.677 1.591 . . . . 0.0 111.297 176.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.64 -41.26 97.3 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.077 0.846 . . . . 0.0 113.813 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.94 -40.22 79.12 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 118.488 1.144 . . . . 0.0 112.682 174.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -64.64 -17.9 64.45 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.212 1.405 . . . . 0.0 114.617 176.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -111.27 -14.97 13.73 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 173.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 70.9 t-105 -67.56 -52.43 38.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.571 1.078 . . . . 0.0 110.906 160.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.3 p -63.32 -19.15 64.35 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.1 -16.92 61.57 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 171.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -134.41 -21.03 0.77 Allowed Glycine 0 CA--C 1.535 1.338 0 CA-C-O 118.209 -1.329 . . . . 0.0 114.895 176.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 74.96 19.16 2.43 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.094 2.157 . . . . 0.0 113.625 -167.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.92 43.38 17.54 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.211 1.405 . . . . 0.0 112.569 -170.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -121.03 8.22 10.4 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.593 2.357 . . . . 0.0 112.11 -165.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.44 21.44 58.36 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.567 1.08 . . . . 0.0 114.044 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.293 7.1 p 40.47 77.95 0.4 Allowed Pre-proline 0 N--CA 1.481 1.105 0 C-N-CA 127.086 2.154 . . . . 0.0 113.411 -177.008 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -40.05 -42.26 3.29 Favored 'Trans proline' 0 C--N 1.356 0.949 1 C-N-CA 126.032 4.488 . . . . 0.0 118.481 -163.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.615 HD13 ' H ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -62.92 -8.88 7.95 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.71 1.745 . . . . 0.0 115.71 177.56 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.5 m -127.46 7.57 6.39 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.298 1.839 . . . . 0.0 113.107 176.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -74.15 142.12 78.56 Favored Pre-proline 0 CA--C 1.554 1.116 0 O-C-N 120.909 -1.12 . . . . 0.0 111.477 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -51.58 -38.42 65.08 Favored 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 123.35 2.7 . . . . 0.0 116.992 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -60.06 -20.4 60.68 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.609 2.873 . . . . 0.0 115.447 171.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -102.29 10.0 39.51 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.437 1.495 . . . . 0.0 112.059 171.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 48.47 33.46 4.01 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.129 2.172 . . . . 0.0 115.068 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 54.65 29.52 11.7 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.512 1.525 . . . . 0.0 113.503 -175.046 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 O-C-N 119.344 -2.098 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 120.488 0.185 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.542 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.5 t70 -129.03 -48.44 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 125.312 1.445 . . . . 0.0 113.995 178.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.542 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 72.9 Cg_endo -74.77 -30.02 8.04 Favored 'Trans proline' 0 C--N 1.356 0.935 0 CA-C-N 121.984 1.744 . . . . 0.0 112.99 174.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 43.21 43.56 4.04 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.727 2.411 . . . . 0.0 114.717 171.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.4 mt -68.82 -37.12 78.98 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -174.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -149.3 3.62 0.59 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.553 1.141 . . . . 0.0 114.054 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.507 0 O-C-N 120.958 -1.089 . . . . 0.0 113.507 -176.537 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.3 mtm180 . . . . . 0 N--CA 1.473 0.686 0 CA-C-O 120.537 0.208 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -72.04 -33.69 68.2 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -167.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -97.29 -29.86 13.3 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.301 1.041 . . . . 0.0 111.086 175.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -57.28 -41.76 93.15 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.104 0.859 . . . . 0.0 113.359 169.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.675 0 CA-C-N 118.013 0.906 . . . . 0.0 112.816 172.704 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 . . . . . 0 CA--C 1.548 0.868 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -113.48 -11.83 13.02 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 173.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -67.15 -53.82 27.04 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.369 0.986 . . . . 0.0 110.918 158.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.9 p -63.54 -18.76 64.19 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.54 -16.53 56.52 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 171.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.242 0 CA-C-O 118.255 -1.303 . . . . 0.0 115.134 178.246 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 . . . . . 0 N--CA 1.48 1.044 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.69 41.05 13.15 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.591 1.556 . . . . 0.0 112.89 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.4 tpt85 -112.92 6.68 17.96 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 127.609 2.364 . . . . 0.0 112.142 -169.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.13 22.23 59.5 Favored Glycine 0 CA--C 1.532 1.146 0 CA-C-O 118.687 -1.063 . . . . 0.0 113.761 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.288 7.1 p 40.4 77.98 0.39 Allowed Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 127.308 2.243 . . . . 0.0 113.441 -177.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -39.09 -44.54 2.62 Favored 'Trans proline' 0 C--N 1.355 0.895 1 C-N-CA 126.101 4.534 . . . . 0.0 118.417 -164.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.618 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -62.26 -9.9 9.29 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 178.059 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.7 m -129.9 7.59 5.17 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.512 1.925 . . . . 0.0 113.044 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -71.41 140.06 84.6 Favored Pre-proline 0 CA--C 1.554 1.104 0 O-C-N 121.023 -1.048 . . . . 0.0 110.523 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -48.24 -39.29 34.63 Favored 'Trans proline' 0 CA--C 1.549 1.23 0 C-N-CA 123.492 2.795 . . . . 0.0 117.66 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -61.22 -18.63 59.68 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 123.481 2.787 . . . . 0.0 115.419 173.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -104.23 4.39 33.8 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.517 1.527 . . . . 0.0 112.532 172.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.52 46.7 8.22 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.2 2.2 . . . . 0.0 115.56 173.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.6 mt . . . . . 0 N--CA 1.479 1.004 0 C-N-CA 126.258 1.823 . . . . 0.0 114.731 -179.126 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 120.607 0.242 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.546 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.0 t70 -133.65 -49.05 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.169 1.388 . . . . 0.0 113.796 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.546 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 60.2 Cg_endo -73.03 -33.86 7.05 Favored 'Trans proline' 0 C--N 1.357 0.977 0 CA-C-N 122.06 1.771 . . . . 0.0 112.918 174.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.48 39.53 3.26 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 127.566 2.346 . . . . 0.0 114.873 172.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.5 mt -72.32 -31.74 65.93 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -175.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -148.38 2.93 0.66 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.651 0 O-C-N 120.99 -1.069 . . . . 0.0 113.42 -177.289 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.0 mtm180 . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.3 0.095 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -72.83 -19.03 61.4 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 -167.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -117.3 -28.37 6.17 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.493 1.517 . . . . 0.0 111.339 176.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.88 -41.04 91.23 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.042 0.829 . . . . 0.0 113.22 167.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.644 0 CA-C-N 118.054 0.927 . . . . 0.0 112.811 172.039 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.1 t70 . . . . . 0 CA--C 1.547 0.848 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -113.27 -13.87 12.9 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 172.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -66.76 -53.37 33.78 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.46 1.027 . . . . 0.0 111.001 160.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.1 p -62.56 -18.65 62.5 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.02 -14.63 60.9 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 171.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.294 0 CA-C-O 118.021 -1.433 . . . . 0.0 115.975 179.792 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.31 43.98 15.61 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 125.375 1.47 . . . . 0.0 112.674 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.1 tpt85 -121.86 19.02 11.01 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.651 2.38 . . . . 0.0 111.341 -166.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.14 23.15 61.79 Favored Glycine 0 CA--C 1.532 1.141 0 CA-C-O 118.854 -0.97 . . . . 0.0 113.969 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.289 7.1 p 42.67 75.99 0.57 Allowed Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 127.043 2.137 . . . . 0.0 113.384 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -40.61 -44.33 4.48 Favored 'Trans proline' 0 C--N 1.354 0.841 1 C-N-CA 125.643 4.229 . . . . 0.0 117.941 -167.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.584 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.99 -8.99 13.23 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 178.171 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.5 m -133.28 5.85 3.81 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.799 2.04 . . . . 0.0 113.217 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -66.88 138.97 95.43 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.577 1.151 . . . . 0.0 110.435 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -47.95 -40.1 32.73 Favored 'Trans proline' 0 CA--C 1.548 1.214 0 C-N-CA 123.278 2.652 . . . . 0.0 117.812 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -61.33 -19.47 64.19 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.36 2.707 . . . . 0.0 115.446 174.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -102.01 -1.7 31.23 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.119 1.368 . . . . 0.0 112.757 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.44 39.11 4.25 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.097 2.159 . . . . 0.0 115.595 175.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 CA--C 1.554 1.098 0 C-N-CA 126.327 1.851 . . . . 0.0 114.097 -177.97 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 120.435 0.16 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.474 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.8 t70 -114.04 -47.88 0.05 OUTLIER Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 125.135 1.374 . . . . 0.0 113.805 176.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.474 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 59.6 Cg_endo -74.16 -39.69 1.55 Allowed 'Trans proline' 0 C--N 1.357 1.02 0 CA-C-N 122.05 1.768 . . . . 0.0 112.957 176.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.87 35.22 1.42 Allowed 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 127.301 2.241 . . . . 0.0 114.822 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.35 -29.58 62.75 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.009 -1.057 . . . . 0.0 113.772 -175.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -146.72 0.38 0.76 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.564 1.146 . . . . 0.0 113.789 178.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.665 0 C-N-CA 124.309 1.044 . . . . 0.0 113.203 -177.267 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 . . . . . 0 N--CA 1.472 0.649 0 CA-C-O 120.346 0.117 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -73.67 -47.49 39.42 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.715 1.206 . . . . 0.0 114.024 -168.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -81.69 -29.66 32.94 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.564 0.746 . . . . 0.0 111.283 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.23 -44.68 89.08 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.058 0.837 . . . . 0.0 112.792 167.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.555 0 CA-C-N 118.031 0.915 . . . . 0.0 112.623 173.542 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.9 t70 . . . . . 0 CA--C 1.547 0.851 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -115.87 -15.38 11.26 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 172.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 71.8 t-105 -66.44 -51.65 54.63 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.312 0.96 . . . . 0.0 111.179 162.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 82.8 p -62.87 -19.48 64.2 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.59 -13.72 59.63 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 172.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.308 0 CA-C-O 117.724 -1.598 . . . . 0.0 116.11 -179.616 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 . . . . . 0 N--CA 1.479 1.018 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.97 31.92 2.61 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 125.968 1.707 . . . . 0.0 113.709 -170.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -93.78 -8.83 39.48 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.786 2.035 . . . . 0.0 113.084 -174.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.46 26.52 6.49 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.51 1.052 . . . . 0.0 113.325 -176.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.295 8.2 p 44.39 74.19 0.83 Allowed Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 127.45 2.3 . . . . 0.0 113.604 -177.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -41.91 -42.03 6.6 Favored 'Trans proline' 0 C--N 1.354 0.848 1 C-N-CA 125.375 4.05 . . . . 0.0 117.592 -171.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.585 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.1 -9.24 37.47 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 177.511 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 61.0 m -133.47 -0.64 3.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.929 2.092 . . . . 0.0 113.736 176.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -54.44 138.52 59.49 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 126.116 1.766 . . . . 0.0 111.256 174.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -46.17 -41.1 21.83 Favored 'Trans proline' 0 CA--C 1.547 1.172 0 C-N-CA 123.696 2.931 . . . . 0.0 117.967 -176.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -61.97 -22.61 74.61 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 123.328 2.685 . . . . 0.0 115.078 175.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -96.42 -10.58 27.25 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.764 1.226 . . . . 0.0 112.954 172.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.2 40.76 5.28 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.738 2.015 . . . . 0.0 115.317 176.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 CA--C 1.553 1.075 0 C-N-CA 126.442 1.897 . . . . 0.0 114.703 -177.104 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.703 0.287 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.585 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.8 t70 -134.47 -48.69 0.03 OUTLIER Pre-proline 0 CA--C 1.548 0.895 0 CA-C-O 117.319 -1.324 . . . . 0.0 113.461 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.585 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 57.9 Cg_endo -72.59 -36.45 5.01 Favored 'Trans proline' 0 C--N 1.356 0.922 0 CA-C-N 121.872 1.704 . . . . 0.0 112.984 175.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.24 38.01 3.13 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 127.361 2.264 . . . . 0.0 114.911 174.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 99.0 mt -74.57 -27.7 60.61 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -175.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -147.46 -1.43 0.62 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.674 1.19 . . . . 0.0 113.837 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.627 0 O-C-N 121.057 -1.027 . . . . 0.0 113.235 -177.807 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 . . . . . 0 N--CA 1.471 0.593 0 CA-C-O 119.742 -0.17 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptm85 -71.1 -37.88 72.37 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 -167.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -93.15 -30.15 15.38 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.209 1.004 . . . . 0.0 111.621 177.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.33 -44.3 76.0 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 123.757 0.694 . . . . 0.0 112.606 166.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.609 0 CA-C-N 117.966 0.883 . . . . 0.0 113.042 174.438 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.5 t70 . . . . . 0 CA--C 1.549 0.925 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -119.31 -14.1 9.24 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -66.86 -49.08 66.81 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.8 1.182 . . . . 0.0 111.255 161.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 81.0 p -63.01 -15.68 57.25 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.29 -11.84 60.08 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 171.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.189 0 CA-C-O 117.677 -1.624 . . . . 0.0 116.626 -179.071 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 113.788 1.032 . . . . 0.0 113.788 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.09 44.97 19.5 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.139 1.376 . . . . 0.0 112.525 -170.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.3 tpt85 -123.93 17.06 9.35 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.934 2.494 . . . . 0.0 111.454 -165.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.68 22.06 62.68 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.452 1.025 . . . . 0.0 114.226 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.5 p 42.45 79.97 0.3 Allowed Pre-proline 0 N--CA 1.481 1.098 0 C-N-CA 127.055 2.142 . . . . 0.0 113.592 -174.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -40.6 -44.93 4.58 Favored 'Trans proline' 0 C--N 1.355 0.872 1 C-N-CA 125.659 4.24 . . . . 0.0 117.865 -169.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.606 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.0 -8.49 23.25 Favored 'General case' 0 CA--C 1.551 1.005 0 N-CA-C 115.705 1.742 . . . . 0.0 115.705 177.83 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.5 m -134.0 11.19 3.93 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 127.002 2.121 . . . . 0.0 113.017 176.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -65.89 141.01 97.43 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.401 1.081 . . . . 0.0 110.484 176.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -50.26 -40.05 52.35 Favored 'Trans proline' 0 CA--C 1.549 1.242 0 C-N-CA 122.713 2.275 . . . . 0.0 116.138 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -58.61 -20.39 49.95 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 124.258 3.305 . . . . 0.0 116.174 171.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -104.06 -3.95 23.89 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.377 1.471 . . . . 0.0 112.802 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.14 38.77 3.47 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.09 2.156 . . . . 0.0 115.286 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.8 mp . . . . . 0 CA--C 1.554 1.11 0 C-N-CA 126.475 1.91 . . . . 0.0 114.195 -177.593 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 110.505 -0.183 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -66.96 -48.07 51.58 Favored Pre-proline 0 CA--C 1.554 1.098 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 175.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.88 -35.85 1.3 Allowed 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 121.865 1.71 . . . . 0.0 113.496 -178.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 45.81 35.15 2.13 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 127.16 2.184 . . . . 0.0 114.886 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.4 mt -74.29 -27.39 60.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 -175.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -147.86 -4.55 0.49 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.672 0 O-C-N 121.112 -0.992 . . . . 0.0 113.501 -176.54 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.2 mtm180 . . . . . 0 N--CA 1.472 0.672 0 CA-C-O 120.363 0.125 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -73.2 -49.85 25.74 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.96 1.304 . . . . 0.0 114.014 -168.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -80.47 -30.05 37.46 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.75 0.82 . . . . 0.0 111.259 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.28 -44.4 89.37 Favored Glycine 0 CA--C 1.535 1.328 0 C-N-CA 123.896 0.76 . . . . 0.0 113.068 167.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.603 0 CA-C-N 118.164 0.982 . . . . 0.0 112.753 174.018 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 CA--C 1.548 0.89 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -118.52 -15.55 9.59 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 114.517 1.302 . . . . 0.0 114.517 172.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.3 t-105 -65.26 -50.6 65.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.588 1.085 . . . . 0.0 111.091 161.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.4 p -62.28 -20.52 64.38 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.04 -12.28 59.46 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 173.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.355 0 CA-C-O 117.942 -1.476 . . . . 0.0 115.818 -179.772 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 113.842 1.053 . . . . 0.0 113.842 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.48 42.33 14.31 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.442 1.497 . . . . 0.0 112.879 -171.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.1 tpt85 -122.73 15.93 10.22 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.355 2.262 . . . . 0.0 111.68 -168.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.6 26.51 42.33 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 124.4 1.0 . . . . 0.0 114.238 174.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.6 p 43.46 74.29 0.8 Allowed Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.702 2.001 . . . . 0.0 113.205 -176.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -41.36 -43.5 5.65 Favored 'Trans proline' 0 C--N 1.354 0.841 1 C-N-CA 125.453 4.102 . . . . 0.0 117.727 -169.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.589 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.96 -9.54 22.25 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 178.093 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -133.2 5.65 3.82 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 126.577 1.951 . . . . 0.0 113.267 176.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -65.03 138.67 97.52 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.767 1.227 . . . . 0.0 110.608 174.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -47.61 -40.12 30.18 Favored 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 123.377 2.718 . . . . 0.0 117.653 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.02 -20.51 69.88 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.344 2.696 . . . . 0.0 115.23 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -99.02 -2.41 37.3 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.02 1.328 . . . . 0.0 112.707 172.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.71 37.66 3.54 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.08 2.152 . . . . 0.0 115.46 176.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp . . . . . 0 CA--C 1.554 1.132 0 C-N-CA 126.422 1.889 . . . . 0.0 114.045 -177.714 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 120.452 0.168 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.58 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 28.2 t70 -129.34 -47.28 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 125.334 1.454 . . . . 0.0 114.118 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.58 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 61.3 Cg_endo -73.35 -34.01 6.43 Favored 'Trans proline' 0 C--N 1.355 0.917 0 CA-C-N 122.037 1.763 . . . . 0.0 112.904 175.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 45.7 35.54 2.23 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 127.476 2.311 . . . . 0.0 115.014 173.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.71 -32.21 69.34 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -175.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -147.94 1.07 0.65 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.664 0 O-C-N 121.046 -1.034 . . . . 0.0 113.246 -176.811 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 . . . . . 0 N--CA 1.472 0.648 0 N-CA-C 110.788 -0.078 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -68.53 -49.41 59.78 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.783 1.233 . . . . 0.0 113.652 -168.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -83.36 -30.77 27.16 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.745 0.818 . . . . 0.0 111.365 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.46 -44.88 85.34 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.138 0.875 . . . . 0.0 113.011 169.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.626 0 CA-C-N 118.037 0.919 . . . . 0.0 112.83 174.515 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.5 t70 . . . . . 0 CA--C 1.547 0.837 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -115.35 -13.14 11.68 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 173.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.4 t-105 -67.1 -53.23 32.77 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.451 1.023 . . . . 0.0 111.125 159.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.0 p -63.43 -18.82 64.13 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.76 -16.47 57.93 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.679 1.191 . . . . 0.0 114.126 171.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.359 0 CA-C-O 118.15 -1.361 . . . . 0.0 115.335 177.418 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.76 42.99 16.54 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.392 1.477 . . . . 0.0 112.808 -172.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.8 tpt85 -120.61 8.8 10.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.77 2.428 . . . . 0.0 111.844 -166.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.52 21.95 59.27 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.581 1.086 . . . . 0.0 113.913 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.294 7.5 p 42.63 77.95 0.41 Allowed Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 127.121 2.168 . . . . 0.0 113.545 -177.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -39.87 -43.84 3.46 Favored 'Trans proline' 0 C--N 1.356 0.923 1 C-N-CA 125.954 4.436 . . . . 0.0 118.128 -166.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.615 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.92 -9.4 20.99 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.715 1.746 . . . . 0.0 115.715 178.293 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.3 m -134.75 7.48 3.51 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.677 1.991 . . . . 0.0 113.118 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -63.13 138.87 97.45 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.83 1.252 . . . . 0.0 111.011 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.45 -40.91 29.46 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 123.427 2.751 . . . . 0.0 117.526 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -63.45 -22.32 71.24 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.237 2.625 . . . . 0.0 115.1 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -95.95 -10.86 27.61 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.734 1.214 . . . . 0.0 112.863 172.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.08 42.54 6.68 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.879 2.071 . . . . 0.0 115.018 177.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 CA--C 1.553 1.065 0 C-N-CA 126.576 1.951 . . . . 0.0 114.376 -178.399 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.1 mmt180 . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -68.74 -47.56 32.69 Favored Pre-proline 0 CA--C 1.553 1.08 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 173.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.76 -36.9 1.38 Allowed 'Trans proline' 0 C--N 1.357 1.008 0 CA-C-N 121.868 1.703 . . . . 0.0 113.299 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 44.68 35.6 1.48 Allowed 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 127.429 2.292 . . . . 0.0 115.149 176.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -70.72 -32.48 69.68 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -148.08 1.9 0.66 Allowed 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 178.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.658 0 C-N-CA 124.207 1.003 . . . . 0.0 113.293 -177.126 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.9 mtm180 . . . . . 0 N--CA 1.472 0.664 0 CA-C-O 120.041 -0.028 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -68.75 -50.69 48.48 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.453 1.101 . . . . 0.0 113.669 -169.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -81.43 -31.12 33.27 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.705 0.802 . . . . 0.0 111.386 177.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.45 -43.7 90.28 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 123.996 0.808 . . . . 0.0 113.239 169.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.592 0 CA-C-N 118.219 1.01 . . . . 0.0 112.782 174.482 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 t70 . . . . . 0 CA--C 1.549 0.909 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -117.77 -13.3 10.16 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 65.5 t-105 -65.37 -52.27 54.73 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.574 1.079 . . . . 0.0 110.911 158.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.1 p -62.66 -20.34 64.72 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.87 -14.87 56.84 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.285 0 CA-C-O 118.198 -1.335 . . . . 0.0 115.089 177.638 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.79 43.44 17.04 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.328 1.451 . . . . 0.0 112.708 -172.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -120.83 13.42 11.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.763 2.425 . . . . 0.0 111.501 -166.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.3 25.24 48.66 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.344 0.973 . . . . 0.0 114.015 177.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.276 7.4 p 44.25 76.47 0.53 Allowed Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.705 2.002 . . . . 0.0 113.326 -177.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -41.82 -43.49 6.73 Favored 'Trans proline' 0 C--N 1.354 0.816 1 C-N-CA 125.31 4.007 . . . . 0.0 117.501 -170.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.591 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.25 -7.93 27.92 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 178.219 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.9 m -132.37 4.47 4.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.661 1.985 . . . . 0.0 113.31 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -65.18 138.65 97.34 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.986 1.314 . . . . 0.0 111.029 178.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -47.85 -41.01 32.46 Favored 'Trans proline' 0 CA--C 1.548 1.206 0 C-N-CA 123.488 2.792 . . . . 0.0 117.475 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.64 -20.8 71.9 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.342 2.695 . . . . 0.0 115.052 175.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -97.13 -3.15 41.64 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.918 1.287 . . . . 0.0 112.806 172.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 46.01 38.43 4.67 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.727 2.011 . . . . 0.0 115.028 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 CA--C 1.552 1.043 0 C-N-CA 126.393 1.877 . . . . 0.0 115.022 -174.939 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 110.811 -0.07 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -68.35 -48.06 36.1 Favored Pre-proline 0 CA--C 1.554 1.105 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 172.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -76.48 -42.2 0.38 Allowed 'Trans proline' 0 C--N 1.357 0.993 0 CA-C-N 121.924 1.723 . . . . 0.0 113.364 -178.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.74 33.93 1.07 Allowed 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 127.271 2.229 . . . . 0.0 114.907 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.4 mt -72.57 -31.02 64.91 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.985 -1.072 . . . . 0.0 113.601 -176.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -147.55 3.15 0.75 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.509 1.124 . . . . 0.0 113.891 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.681 0 O-C-N 121.029 -1.044 . . . . 0.0 113.269 -176.442 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.9 mtm180 . . . . . 0 N--CA 1.473 0.703 0 CA-C-O 120.387 0.137 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -67.23 -52.15 44.54 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.188 1.395 . . . . 0.0 113.792 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -80.94 -29.64 35.39 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.595 0.758 . . . . 0.0 111.48 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.9 -42.36 86.11 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.06 0.838 . . . . 0.0 113.209 168.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.657 0 CA-C-N 118.014 0.907 . . . . 0.0 112.927 173.667 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.8 t70 . . . . . 0 CA--C 1.547 0.853 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -112.66 -14.91 13.09 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 172.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -65.55 -52.68 50.63 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 119.41 1.004 . . . . 0.0 111.14 161.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.2 p -63.19 -20.83 65.77 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.65 -16.05 62.21 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 173.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.347 0 CA-C-O 118.327 -1.263 . . . . 0.0 115.064 177.989 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.14 45.69 19.66 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.117 1.367 . . . . 0.0 112.355 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.9 tpt85 -122.07 14.36 10.62 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.788 2.435 . . . . 0.0 111.657 -163.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.65 21.6 71.66 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-O 118.701 -1.055 . . . . 0.0 113.734 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.287 6.7 p 42.01 81.58 0.24 Allowed Pre-proline 0 N--CA 1.48 1.04 0 C-N-CA 127.406 2.283 . . . . 0.0 113.688 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -41.27 -43.43 5.43 Favored 'Trans proline' 0 C--N 1.354 0.839 1 C-N-CA 125.623 4.215 . . . . 0.0 118.085 -166.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.636 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.64 -7.74 22.61 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 178.306 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.5 m -127.95 -3.53 5.79 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.476 1.91 . . . . 0.0 113.4 175.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -62.2 137.28 95.79 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.18 1.392 . . . . 0.0 111.044 175.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.02 -39.64 33.07 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.481 2.787 . . . . 0.0 117.662 -178.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -61.61 -17.3 53.55 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.488 2.792 . . . . 0.0 115.516 174.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -107.25 2.27 24.53 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.395 1.478 . . . . 0.0 112.709 172.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 42.76 47.13 4.64 Favored 'General case' 0 CA--C 1.55 0.981 0 C-N-CA 127.353 2.261 . . . . 0.0 115.881 172.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 18.8 mt . . . . . 0 N--CA 1.481 1.076 0 C-N-CA 125.808 1.643 . . . . 0.0 114.69 -179.817 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.56 0.219 . . . . 0.0 111.37 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.576 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 28.2 t70 -130.83 -47.9 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.983 0 C-N-CA 125.26 1.424 . . . . 0.0 114.138 -178.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.576 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 60.1 Cg_endo -73.2 -33.96 6.7 Favored 'Trans proline' 0 C--N 1.357 0.988 0 CA-C-N 122.211 1.825 . . . . 0.0 113.028 175.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.75 30.13 1.75 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.415 2.286 . . . . 0.0 115.355 175.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.15 -33.99 74.29 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.011 -1.056 . . . . 0.0 113.724 -175.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -149.04 2.17 0.57 Allowed 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.633 0 C-N-CA 124.415 1.086 . . . . 0.0 113.307 -176.854 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.0 mtm180 . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 120.153 0.025 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -69.35 -40.86 77.25 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -168.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -91.3 -29.15 17.31 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.146 0.979 . . . . 0.0 111.418 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.52 -42.99 77.63 Favored Glycine 0 CA--C 1.538 1.483 0 C-N-CA 123.908 0.766 . . . . 0.0 112.946 167.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.599 0 CA-C-N 117.987 0.894 . . . . 0.0 113.083 174.056 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 CA--C 1.547 0.851 0 N-CA-C 114.436 1.272 . . . . 0.0 114.436 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -115.8 -14.4 11.36 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 172.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -65.99 -51.95 53.83 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.529 1.059 . . . . 0.0 111.087 160.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.2 p -62.85 -19.0 63.7 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.83 -15.23 58.32 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.29 1.219 . . . . 0.0 114.29 172.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.313 0 CA-C-O 118.291 -1.283 . . . . 0.0 115.211 177.67 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.77 44.17 17.6 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.173 1.389 . . . . 0.0 112.522 -171.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.6 tpt85 -121.68 12.83 10.72 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 127.724 2.41 . . . . 0.0 111.662 -165.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.46 22.82 57.88 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.576 1.084 . . . . 0.0 114.056 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.286 7.3 p 43.34 77.32 0.45 Allowed Pre-proline 0 N--CA 1.479 1.018 0 C-N-CA 126.866 2.067 . . . . 0.0 113.392 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -40.57 -43.57 4.29 Favored 'Trans proline' 0 C--N 1.355 0.881 1 C-N-CA 125.61 4.207 . . . . 0.0 117.985 -167.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.592 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.73 -9.48 20.44 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 178.03 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.3 m -134.08 6.14 3.61 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.688 1.995 . . . . 0.0 113.26 176.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -64.09 139.43 97.68 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 124.747 1.219 . . . . 0.0 110.704 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.19 -40.55 27.36 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 123.456 2.771 . . . . 0.0 117.623 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -62.34 -21.74 73.09 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.35 2.7 . . . . 0.0 115.194 174.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -98.44 -7.4 28.67 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.939 1.296 . . . . 0.0 112.782 172.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.79 40.92 4.62 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.028 2.131 . . . . 0.0 115.321 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.5 mp . . . . . 0 CA--C 1.553 1.059 0 C-N-CA 126.468 1.907 . . . . 0.0 114.225 -178.338 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 110.826 -0.064 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -74.01 -47.67 6.36 Favored Pre-proline 0 CA--C 1.553 1.091 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 174.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.66 -32.73 2.64 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 121.915 1.743 . . . . 0.0 113.526 -176.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.95 31.56 2.42 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 127.257 2.223 . . . . 0.0 115.583 174.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.35 -34.74 75.04 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -173.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -148.44 0.78 0.6 Allowed 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.704 0 C-N-CA 124.39 1.076 . . . . 0.0 113.504 -176.11 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 120.5 0.191 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -73.25 -46.81 47.85 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.946 1.298 . . . . 0.0 114.044 -168.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -82.05 -27.64 32.9 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.597 0.759 . . . . 0.0 111.243 175.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.23 -43.31 84.09 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 123.977 0.799 . . . . 0.0 113.172 166.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.688 0 CA-C-N 118.142 0.971 . . . . 0.0 113.103 174.201 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 CA--C 1.548 0.879 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -117.87 -10.84 10.37 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 172.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -68.0 -51.45 47.04 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.649 1.113 . . . . 0.0 111.065 158.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.8 p -63.18 -16.13 59.13 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.99 -13.73 58.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 171.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.287 0 CA-C-O 117.929 -1.484 . . . . 0.0 116.122 179.983 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.47 42.85 15.08 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.32 1.448 . . . . 0.0 112.785 -171.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.8 tpt85 -116.79 12.73 14.91 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.626 2.371 . . . . 0.0 111.732 -167.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.87 20.91 60.34 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 124.588 1.09 . . . . 0.0 113.937 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.4 p 41.61 77.89 0.41 Allowed Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 126.989 2.115 . . . . 0.0 113.245 -175.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -41.17 -41.26 4.52 Favored 'Trans proline' 0 C--N 1.354 0.863 1 C-N-CA 125.883 4.389 . . . . 0.0 118.496 -165.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.585 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.29 -9.61 18.64 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 176.808 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 65.3 m -133.57 14.05 4.08 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.108 2.163 . . . . 0.0 112.917 177.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.58 140.35 96.45 Favored Pre-proline 0 CA--C 1.551 1.015 0 O-C-N 120.896 -1.128 . . . . 0.0 111.224 177.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -51.82 -39.97 66.89 Favored 'Trans proline' 0 CA--C 1.549 1.227 0 C-N-CA 122.941 2.427 . . . . 0.0 116.193 174.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -60.36 -21.63 68.04 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.484 2.79 . . . . 0.0 115.618 172.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -95.72 0.76 52.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.885 1.274 . . . . 0.0 112.629 171.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 47.03 33.95 2.56 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.909 2.084 . . . . 0.0 114.803 -177.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 CA--C 1.553 1.072 0 C-N-CA 126.477 1.911 . . . . 0.0 114.008 -175.831 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 110.727 -0.101 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -70.57 -49.39 15.72 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 173.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -79.8 -34.89 0.84 Allowed 'Trans proline' 0 C--N 1.357 0.976 0 CA-C-N 121.874 1.705 . . . . 0.0 113.684 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 43.32 37.95 1.52 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 127.295 2.238 . . . . 0.0 113.982 -176.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.6 -39.3 77.35 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.494 1.118 . . . . 0.0 112.562 -171.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -143.99 2.67 1.19 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.812 1.245 . . . . 0.0 113.534 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.682 0 O-C-N 120.969 -1.082 . . . . 0.0 113.414 -176.38 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 120.421 0.153 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -69.64 -53.7 17.46 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.223 1.409 . . . . 0.0 113.801 -169.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -77.44 -31.14 53.68 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.645 0.778 . . . . 0.0 111.427 177.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -57.2 -42.76 93.52 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.141 0.877 . . . . 0.0 113.364 169.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.61 0 CA-C-N 118.183 0.992 . . . . 0.0 112.776 173.857 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 . . . . . 0 CA--C 1.549 0.91 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -113.54 -13.31 12.79 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 172.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.8 t-105 -67.49 -51.8 46.85 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.475 1.034 . . . . 0.0 111.192 160.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.6 p -63.51 -17.9 63.25 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.422 1.268 . . . . 0.0 114.422 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.85 -16.17 57.45 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.681 1.192 . . . . 0.0 114.192 171.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.295 0 C-N-CA 124.862 1.22 . . . . 0.0 114.85 175.821 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.63 43.66 16.6 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.242 1.417 . . . . 0.0 112.581 -170.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -117.57 10.47 13.48 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 127.502 2.321 . . . . 0.0 112.086 -165.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.96 21.52 65.52 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 118.805 -0.997 . . . . 0.0 113.676 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.288 7.2 p 40.16 78.54 0.36 Allowed Pre-proline 0 N--CA 1.48 1.05 0 C-N-CA 127.3 2.24 . . . . 0.0 113.513 -177.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -40.1 -41.86 3.24 Favored 'Trans proline' 0 C--N 1.355 0.897 1 C-N-CA 126.091 4.527 . . . . 0.0 118.71 -164.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.613 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.52 -9.33 12.55 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 177.283 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.9 m -129.32 9.17 5.59 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.517 1.927 . . . . 0.0 113.004 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -70.49 140.04 87.03 Favored Pre-proline 0 CA--C 1.551 0.992 0 O-C-N 120.94 -1.1 . . . . 0.0 111.301 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -51.3 -39.79 62.32 Favored 'Trans proline' 0 CA--C 1.548 1.207 0 C-N-CA 123.177 2.585 . . . . 0.0 116.511 175.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -60.07 -20.38 60.68 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.548 2.832 . . . . 0.0 115.709 172.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.16 2.16 42.73 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.045 1.338 . . . . 0.0 112.575 172.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 46.29 37.06 3.74 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.721 2.009 . . . . 0.0 114.653 -178.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.2 mp . . . . . 0 CA--C 1.553 1.075 0 C-N-CA 126.413 1.885 . . . . 0.0 114.104 -176.859 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 120.44 0.162 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.468 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.7 t70 -113.23 -48.15 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.085 1.354 . . . . 0.0 113.65 176.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 69.7 Cg_endo -75.7 -36.39 2.18 Favored 'Trans proline' 0 C--N 1.357 0.98 0 CA-C-N 122.049 1.767 . . . . 0.0 113.112 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 43.01 37.97 1.29 Allowed 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 127.544 2.337 . . . . 0.0 114.713 178.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 98.2 mt -70.91 -32.45 69.38 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -148.63 3.29 0.64 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.686 0 O-C-N 121.025 -1.047 . . . . 0.0 113.195 -176.918 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 . . . . . 0 N--CA 1.474 0.727 0 CA-C-O 120.168 0.032 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -68.69 -48.06 64.86 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.875 1.27 . . . . 0.0 114.153 -169.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -83.77 -29.53 27.35 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.803 0.841 . . . . 0.0 111.408 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.57 -41.93 89.72 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 123.999 0.809 . . . . 0.0 113.172 168.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.584 0 CA-C-N 118.142 0.971 . . . . 0.0 112.834 173.892 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 CA--C 1.548 0.887 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -114.17 -11.55 12.64 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 172.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -68.4 -53.49 23.47 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.48 1.036 . . . . 0.0 110.995 158.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.9 p -63.63 -17.62 63.09 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.37 -16.37 54.18 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.325 1.232 . . . . 0.0 114.325 171.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.288 0 CA-C-O 118.034 -1.426 . . . . 0.0 115.671 178.172 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.26 45.12 20.14 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.98 1.312 . . . . 0.0 112.44 -170.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -121.85 12.81 10.59 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 127.938 2.495 . . . . 0.0 111.736 -164.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.6 20.53 68.56 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.519 1.057 . . . . 0.0 114.003 -178.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.292 7.6 p 43.35 80.1 0.3 Allowed Pre-proline 0 N--CA 1.48 1.031 0 C-N-CA 127.167 2.187 . . . . 0.0 113.499 -176.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -41.04 -43.74 4.96 Favored 'Trans proline' 0 C--N 1.355 0.898 1 C-N-CA 125.721 4.281 . . . . 0.0 117.882 -167.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.602 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.53 -7.48 20.25 Favored 'General case' 0 CA--C 1.551 1.018 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 178.497 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.1 m -130.73 -3.24 4.16 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.475 1.91 . . . . 0.0 113.513 175.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.17 138.77 91.48 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 125.69 1.596 . . . . 0.0 111.498 178.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -46.93 -38.93 24.31 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 123.598 2.865 . . . . 0.0 117.997 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -63.17 -20.66 71.47 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.365 2.71 . . . . 0.0 115.171 173.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -103.44 -13.29 16.68 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.147 1.379 . . . . 0.0 112.888 172.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.37 51.43 7.68 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 127.103 2.161 . . . . 0.0 115.039 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 32.9 mt . . . . . 0 N--CA 1.48 1.064 0 C-N-CA 126.36 1.864 . . . . 0.0 114.899 -179.526 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 120.896 0.379 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.563 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.9 t70 -131.89 -48.43 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.309 1.444 . . . . 0.0 113.93 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.563 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 57.1 Cg_endo -72.95 -38.47 2.89 Favored 'Trans proline' 0 C--N 1.356 0.923 0 CA-C-N 122.137 1.799 . . . . 0.0 112.801 174.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.58 36.22 2.46 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 127.309 2.244 . . . . 0.0 114.645 176.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.9 mt -76.4 -24.35 54.05 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -176.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -147.36 -1.62 0.62 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.667 0 O-C-N 121.028 -1.045 . . . . 0.0 113.413 -177.513 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 120.527 0.203 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -71.38 -34.57 70.54 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -168.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -99.27 -27.36 13.82 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.474 1.109 . . . . 0.0 111.337 176.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.4 -40.02 75.32 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.753 0.692 . . . . 0.0 112.894 164.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.646 0 CA-C-N 118.083 0.941 . . . . 0.0 112.933 172.533 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.5 t70 . . . . . 0 CA--C 1.55 0.963 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -120.63 -11.72 9.01 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 70.8 t-105 -65.3 -50.17 66.71 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.664 1.12 . . . . 0.0 110.91 159.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.5 p -62.03 -16.63 53.23 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.19 -13.9 61.01 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 171.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.394 0 CA-C-O 117.874 -1.514 . . . . 0.0 116.14 179.806 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.78 45.21 18.37 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.392 1.477 . . . . 0.0 112.385 -171.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 tpt85 -124.93 15.06 8.56 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 127.963 2.505 . . . . 0.0 111.638 -163.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.3 16.83 68.13 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.724 1.154 . . . . 0.0 114.195 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.303 6.8 p 44.81 80.08 0.31 Allowed Pre-proline 0 N--CA 1.479 1.013 0 C-N-CA 127.07 2.148 . . . . 0.0 113.124 -173.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -41.72 -43.39 6.49 Favored 'Trans proline' 0 C--N 1.356 0.921 1 C-N-CA 125.553 4.169 . . . . 0.0 118.125 -169.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.619 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.59 -6.56 20.73 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 177.754 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.4 m -133.06 12.58 4.28 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.968 2.107 . . . . 0.0 112.956 176.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -68.66 141.1 92.47 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.829 1.251 . . . . 0.0 111.1 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -52.84 -40.37 75.13 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 123.237 2.625 . . . . 0.0 115.222 172.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -56.85 -19.21 30.57 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.937 3.091 . . . . 0.0 116.463 169.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -106.47 2.83 26.63 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.155 1.382 . . . . 0.0 112.829 173.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.64 47.19 8.62 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.775 2.03 . . . . 0.0 114.676 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.9 mt . . . . . 0 N--CA 1.479 0.987 0 C-N-CA 126.462 1.905 . . . . 0.0 114.894 -177.892 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.547 0.213 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.541 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.0 t70 -129.56 -48.95 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.201 1.4 . . . . 0.0 113.733 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.541 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.0 Cg_endo -73.4 -38.71 2.42 Favored 'Trans proline' 0 C--N 1.357 1.011 0 CA-C-N 122.034 1.762 . . . . 0.0 112.745 174.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.72 34.69 1.87 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 127.294 2.238 . . . . 0.0 114.669 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.4 mt -76.25 -26.22 55.77 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -147.49 0.62 0.69 Allowed 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 -177.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.709 0 C-N-CA 124.364 1.065 . . . . 0.0 113.212 -177.301 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 . . . . . 0 N--CA 1.473 0.687 0 CA-C-O 120.021 -0.038 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -71.23 -30.35 66.24 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 -167.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -102.81 -28.8 11.85 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.799 1.24 . . . . 0.0 111.333 174.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.3 -41.97 81.21 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.741 0.686 . . . . 0.0 112.948 166.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.517 0 CA-C-N 118.06 0.93 . . . . 0.0 113.021 174.32 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 CA--C 1.549 0.904 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -117.77 -13.69 10.15 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 171.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -66.71 -50.03 64.13 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.668 1.122 . . . . 0.0 110.924 159.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.5 p -63.93 -13.74 48.09 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.3 -12.14 59.36 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 170.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.302 0 CA-C-O 117.786 -1.563 . . . . 0.0 116.16 -179.791 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 . . . . . 0 N--CA 1.48 1.044 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.18 42.01 16.68 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.437 1.495 . . . . 0.0 113.043 -172.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.2 tpt85 -120.29 8.49 10.86 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.509 2.324 . . . . 0.0 112.102 -168.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.6 20.83 53.24 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.774 1.178 . . . . 0.0 114.212 176.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.296 7.2 p 43.5 77.68 0.43 Allowed Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 126.82 2.048 . . . . 0.0 113.441 -174.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -41.18 -42.82 5.1 Favored 'Trans proline' 0 C--N 1.355 0.91 1 C-N-CA 125.724 4.283 . . . . 0.0 118.051 -168.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.58 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -65.25 -9.48 24.28 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 177.957 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.9 m -134.09 11.96 3.91 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.659 1.984 . . . . 0.0 112.91 176.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -64.37 140.82 98.05 Favored Pre-proline 0 CA--C 1.548 0.881 0 O-C-N 120.885 -1.134 . . . . 0.0 111.089 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -53.15 -41.51 71.57 Favored 'Trans proline' 0 CA--C 1.55 1.322 0 C-N-CA 122.424 2.083 . . . . 0.0 115.482 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -54.83 -22.22 28.91 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 124.222 3.281 . . . . 0.0 116.764 169.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -100.19 -6.17 26.53 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.572 1.149 . . . . 0.0 113.114 173.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.87 45.48 8.51 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.359 1.864 . . . . 0.0 114.595 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.479 1.016 0 C-N-CA 126.859 2.063 . . . . 0.0 115.16 -177.348 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 120.625 0.25 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.527 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.4 t70 -135.45 -49.86 0.02 OUTLIER Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.086 1.355 . . . . 0.0 113.684 178.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.527 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 59.7 Cg_endo -73.58 -34.2 5.91 Favored 'Trans proline' 0 C--N 1.358 1.034 0 CA-C-N 121.975 1.741 . . . . 0.0 113.035 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 43.54 38.35 1.83 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 127.508 2.323 . . . . 0.0 114.195 178.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.85 -30.67 62.8 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.272 1.029 . . . . 0.0 113.23 -173.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -145.54 -0.77 0.83 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.695 0 O-C-N 121.029 -1.045 . . . . 0.0 113.365 -176.957 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.7 mtm180 . . . . . 0 N--CA 1.474 0.757 0 CA-C-O 120.377 0.132 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -72.08 -43.84 64.21 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.267 1.427 . . . . 0.0 114.568 -169.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -88.22 -27.05 22.05 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.998 0.919 . . . . 0.0 111.48 175.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.24 -43.0 89.31 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 123.612 0.625 . . . . 0.0 112.76 165.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.525 0 CA-C-N 118.048 0.924 . . . . 0.0 112.988 173.651 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.2 t70 . . . . . 0 CA--C 1.548 0.897 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -119.7 -15.43 8.93 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 172.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -67.05 -50.38 62.1 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.387 0.994 . . . . 0.0 111.125 162.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.1 p -63.32 -19.59 64.74 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.9 -14.14 58.85 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 172.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.318 0 CA-C-O 118.008 -1.44 . . . . 0.0 115.377 178.145 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.34 43.52 19.34 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.152 1.381 . . . . 0.0 112.649 -172.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -122.54 9.61 9.65 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.84 2.456 . . . . 0.0 111.887 -164.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.44 21.76 53.22 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.592 1.091 . . . . 0.0 114.233 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.294 7.1 p 43.83 76.01 0.58 Allowed Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 126.804 2.042 . . . . 0.0 113.235 -176.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -40.72 -43.21 4.42 Favored 'Trans proline' 0 C--N 1.355 0.877 1 C-N-CA 125.763 4.309 . . . . 0.0 117.974 -167.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.605 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.03 -9.87 18.61 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.185 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.0 m -131.81 3.29 4.11 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.3 1.84 . . . . 0.0 113.464 175.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -64.95 138.87 97.62 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 124.95 1.3 . . . . 0.0 111.17 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -47.63 -40.36 30.51 Favored 'Trans proline' 0 CA--C 1.548 1.213 0 C-N-CA 123.651 2.901 . . . . 0.0 117.705 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -61.65 -20.61 69.51 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.411 2.74 . . . . 0.0 115.202 174.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -99.52 -2.53 35.62 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.925 1.29 . . . . 0.0 112.776 172.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.81 38.69 4.55 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.755 2.022 . . . . 0.0 115.137 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 CA--C 1.553 1.066 0 C-N-CA 126.337 1.855 . . . . 0.0 114.484 -176.552 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 120.6 0.238 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.533 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.0 t70 -128.41 -48.51 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.235 1.414 . . . . 0.0 113.816 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.533 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.7 Cg_endo -73.49 -38.84 2.29 Favored 'Trans proline' 0 C--N 1.356 0.921 0 CA-C-N 122.086 1.781 . . . . 0.0 112.71 174.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.43 34.92 1.71 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 127.315 2.246 . . . . 0.0 114.728 177.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.5 mt -75.56 -26.15 57.71 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.04 -1.037 . . . . 0.0 113.704 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -147.89 -0.93 0.6 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -178.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.697 0 O-C-N 121.096 -1.002 . . . . 0.0 113.325 -176.803 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.2 mtm180 . . . . . 0 N--CA 1.472 0.675 0 CA-C-O 120.486 0.184 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -69.82 -40.03 76.13 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.238 1.415 . . . . 0.0 114.538 -168.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -93.63 -29.59 15.38 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.393 1.077 . . . . 0.0 111.249 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.46 -41.33 80.47 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 123.876 0.75 . . . . 0.0 113.184 168.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.656 0 CA-C-N 118.072 0.936 . . . . 0.0 112.807 173.099 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.3 t70 . . . . . 0 CA--C 1.549 0.911 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -121.75 -19.0 6.94 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 171.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -62.0 -47.58 84.15 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.624 1.102 . . . . 0.0 111.308 164.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.0 p -61.97 -24.96 67.33 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.14 -5.91 42.25 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.333 0 C-N-CA 124.941 1.258 . . . . 0.0 114.558 177.105 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.44 40.72 15.48 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.667 1.587 . . . . 0.0 113.339 -173.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -113.12 11.96 18.99 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 127.167 2.187 . . . . 0.0 111.969 -171.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.96 26.02 35.85 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 118.911 -0.938 . . . . 0.0 113.921 175.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.283 8.8 p 43.63 72.95 1.04 Allowed Pre-proline 0 N--CA 1.48 1.028 0 C-N-CA 126.644 1.978 . . . . 0.0 113.359 -177.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -41.54 -41.81 5.62 Favored 'Trans proline' 0 C--N 1.355 0.881 1 C-N-CA 125.64 4.227 . . . . 0.0 117.9 -168.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.613 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.27 -10.1 21.62 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 115.666 1.728 . . . . 0.0 115.666 177.629 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.9 m -133.36 3.26 3.61 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.222 1.809 . . . . 0.0 113.666 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -61.86 138.75 95.57 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.02 1.328 . . . . 0.0 111.148 176.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -47.01 -40.86 26.22 Favored 'Trans proline' 0 CA--C 1.548 1.217 0 C-N-CA 123.64 2.893 . . . . 0.0 117.79 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.47 -21.14 72.39 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.24 2.626 . . . . 0.0 115.043 175.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -97.29 -6.63 33.98 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.859 1.263 . . . . 0.0 112.81 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.34 40.26 5.15 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 126.964 2.105 . . . . 0.0 115.104 177.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.1 mp . . . . . 0 CA--C 1.553 1.067 0 C-N-CA 126.564 1.945 . . . . 0.0 115.007 -175.257 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 120.588 0.233 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.54 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.4 t70 -132.19 -49.09 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.993 0 CA-C-O 117.208 -1.377 . . . . 0.0 113.845 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.54 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.2 Cg_endo -73.18 -38.25 2.86 Favored 'Trans proline' 0 C--N 1.357 0.997 0 CA-C-N 122.14 1.8 . . . . 0.0 112.729 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.45 33.31 1.89 Allowed 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 127.244 2.218 . . . . 0.0 114.799 175.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.3 mt -73.69 -28.2 61.62 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.074 -1.016 . . . . 0.0 113.563 -176.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -148.06 2.08 0.67 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.702 0 O-C-N 121.118 -0.988 . . . . 0.0 113.182 -177.187 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 110.86 -0.052 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -66.77 -46.06 76.53 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.862 1.265 . . . . 0.0 114.205 -169.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -88.72 -30.16 19.29 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.128 0.971 . . . . 0.0 111.407 177.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.33 -42.67 89.26 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 123.889 0.757 . . . . 0.0 113.17 170.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.598 0 CA-C-N 118.074 0.937 . . . . 0.0 112.833 173.819 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 t70 . . . . . 0 CA--C 1.547 0.846 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -116.27 -13.41 11.08 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 172.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -67.46 -52.01 44.48 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.489 1.041 . . . . 0.0 111.021 160.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.2 p -62.56 -19.22 63.46 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.45 -13.82 53.64 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 171.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.289 0 CA-C-O 117.836 -1.536 . . . . 0.0 115.722 179.393 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 . . . . . 0 N--CA 1.479 0.983 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.82 37.02 6.54 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.571 1.549 . . . . 0.0 113.106 -171.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 48.5 tpt85 -102.71 -13.62 17.0 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.514 2.326 . . . . 0.0 113.059 -169.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.74 21.29 8.75 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.947 1.261 . . . . 0.0 113.759 -175.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.299 7.7 p 44.86 80.23 0.3 Allowed Pre-proline 0 N--CA 1.48 1.055 0 C-N-CA 127.345 2.258 . . . . 0.0 113.783 -177.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -42.66 -42.33 8.5 Favored 'Trans proline' 0 C--N 1.354 0.862 1 C-N-CA 125.57 4.18 . . . . 0.0 117.961 -170.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.61 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.77 -5.94 18.71 Favored 'General case' 0 CA--C 1.551 1.018 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.621 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.4 m -134.33 12.26 3.84 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 127.221 2.208 . . . . 0.0 112.713 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -65.26 143.59 98.82 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 125.066 1.346 . . . . 0.0 111.931 -177.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.57 -39.6 74.75 Favored 'Trans proline' 0 CA--C 1.548 1.212 0 C-N-CA 123.041 2.494 . . . . 0.0 116.214 173.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -60.02 -20.54 61.14 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.668 2.912 . . . . 0.0 115.602 170.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -99.02 6.67 46.54 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.449 1.5 . . . . 0.0 112.321 171.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 48.46 32.63 3.44 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 127.202 2.201 . . . . 0.0 115.123 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.555 1.165 0 C-N-CA 125.587 1.555 . . . . 0.0 113.597 -174.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -68.13 -49.63 33.95 Favored Pre-proline 0 CA--C 1.554 1.108 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 175.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.48 -42.97 0.19 Allowed 'Trans proline' 0 C--N 1.356 0.948 0 CA-C-N 121.845 1.695 . . . . 0.0 113.461 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.2 32.86 1.58 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 126.968 2.107 . . . . 0.0 114.396 -176.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.6 mt -79.01 -22.51 45.38 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -177.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -146.57 -1.89 0.68 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.645 0 C-N-CA 124.338 1.055 . . . . 0.0 113.297 -177.624 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.7 mtm180 . . . . . 0 N--CA 1.473 0.678 0 CA-C-O 120.216 0.055 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -68.89 -19.26 64.22 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -167.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -120.9 -33.56 3.73 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.677 1.591 . . . . 0.0 111.297 176.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.64 -41.26 97.3 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.077 0.846 . . . . 0.0 113.813 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.597 0 CA-C-N 118.488 1.144 . . . . 0.0 112.682 174.196 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 CA--C 1.547 0.851 0 N-CA-C 114.617 1.339 . . . . 0.0 114.617 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -111.27 -14.97 13.73 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 173.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 70.9 t-105 -67.56 -52.43 38.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.571 1.078 . . . . 0.0 110.906 160.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.3 p -63.32 -19.15 64.35 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.1 -16.92 61.57 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 171.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.338 0 CA-C-O 118.209 -1.329 . . . . 0.0 114.895 176.862 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.92 43.38 17.54 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.211 1.405 . . . . 0.0 112.569 -170.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -121.03 8.22 10.4 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.593 2.357 . . . . 0.0 112.11 -165.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.44 21.44 58.36 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.567 1.08 . . . . 0.0 114.044 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.293 7.1 p 40.47 77.95 0.4 Allowed Pre-proline 0 N--CA 1.481 1.105 0 C-N-CA 127.086 2.154 . . . . 0.0 113.411 -177.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -40.05 -42.26 3.29 Favored 'Trans proline' 0 C--N 1.356 0.949 1 C-N-CA 126.032 4.488 . . . . 0.0 118.481 -163.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.615 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -62.92 -8.88 7.95 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.71 1.745 . . . . 0.0 115.71 177.56 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.5 m -127.46 7.57 6.39 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.298 1.839 . . . . 0.0 113.107 176.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -74.15 142.12 78.56 Favored Pre-proline 0 CA--C 1.554 1.116 0 O-C-N 120.909 -1.12 . . . . 0.0 111.477 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -51.58 -38.42 65.08 Favored 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 123.35 2.7 . . . . 0.0 116.992 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -60.06 -20.4 60.68 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.609 2.873 . . . . 0.0 115.447 171.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -102.29 10.0 39.51 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.437 1.495 . . . . 0.0 112.059 171.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 48.47 33.46 4.01 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.129 2.172 . . . . 0.0 115.068 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.555 1.145 0 C-N-CA 125.512 1.525 . . . . 0.0 113.503 -175.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 120.488 0.185 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.542 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.5 t70 -129.03 -48.44 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 125.312 1.445 . . . . 0.0 113.995 178.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.542 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 72.9 Cg_endo -74.77 -30.02 8.04 Favored 'Trans proline' 0 C--N 1.356 0.935 0 CA-C-N 121.984 1.744 . . . . 0.0 112.99 174.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 43.21 43.56 4.04 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.727 2.411 . . . . 0.0 114.717 171.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.4 mt -68.82 -37.12 78.98 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -174.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -149.3 3.62 0.59 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.553 1.141 . . . . 0.0 114.054 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.64 -33.87 68.74 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.958 -1.089 . . . . 0.0 113.507 -176.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.3 mtm180 -95.59 -64.54 1.05 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.211 1.004 . . . . 0.0 111.044 171.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -72.04 -33.69 68.2 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -167.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -97.29 -29.86 13.3 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.301 1.041 . . . . 0.0 111.086 175.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -57.28 -41.76 93.15 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.104 0.859 . . . . 0.0 113.359 169.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.4 -44.4 75.14 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 118.013 0.906 . . . . 0.0 112.816 172.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.38 -18.45 61.57 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.271 1.428 . . . . 0.0 114.418 174.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -113.48 -11.83 13.02 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 173.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -67.15 -53.82 27.04 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.369 0.986 . . . . 0.0 110.918 158.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.9 p -63.54 -18.76 64.19 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.54 -16.53 56.52 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 171.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.26 -23.57 0.34 Allowed Glycine 0 CA--C 1.534 1.242 0 CA-C-O 118.255 -1.303 . . . . 0.0 115.134 178.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 68.68 21.48 7.85 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.139 1.776 . . . . 0.0 113.889 -165.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.69 41.05 13.15 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.591 1.556 . . . . 0.0 112.89 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.4 tpt85 -112.92 6.68 17.96 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 127.609 2.364 . . . . 0.0 112.142 -169.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.13 22.23 59.5 Favored Glycine 0 CA--C 1.532 1.146 0 CA-C-O 118.687 -1.063 . . . . 0.0 113.761 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.288 7.1 p 40.4 77.98 0.39 Allowed Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 127.308 2.243 . . . . 0.0 113.441 -177.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -39.09 -44.54 2.62 Favored 'Trans proline' 0 C--N 1.355 0.895 1 C-N-CA 126.101 4.534 . . . . 0.0 118.417 -164.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.618 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -62.26 -9.9 9.29 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 178.059 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.7 m -129.9 7.59 5.17 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.512 1.925 . . . . 0.0 113.044 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -71.41 140.06 84.6 Favored Pre-proline 0 CA--C 1.554 1.104 0 O-C-N 121.023 -1.048 . . . . 0.0 110.523 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -48.24 -39.29 34.63 Favored 'Trans proline' 0 CA--C 1.549 1.23 0 C-N-CA 123.492 2.795 . . . . 0.0 117.66 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -61.22 -18.63 59.68 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 123.481 2.787 . . . . 0.0 115.419 173.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -104.23 4.39 33.8 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.517 1.527 . . . . 0.0 112.532 172.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.52 46.7 8.22 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.2 2.2 . . . . 0.0 115.56 173.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.6 mt 59.91 16.77 5.99 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 126.258 1.823 . . . . 0.0 114.731 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 O-C-N 119.585 -1.947 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 120.607 0.242 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.546 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.0 t70 -133.65 -49.05 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.169 1.388 . . . . 0.0 113.796 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.546 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 60.2 Cg_endo -73.03 -33.86 7.05 Favored 'Trans proline' 0 C--N 1.357 0.977 0 CA-C-N 122.06 1.771 . . . . 0.0 112.918 174.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.48 39.53 3.26 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 127.566 2.346 . . . . 0.0 114.873 172.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.5 mt -72.32 -31.74 65.93 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -175.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -148.38 2.93 0.66 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.91 -33.54 68.87 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.99 -1.069 . . . . 0.0 113.42 -177.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.0 mtm180 -98.36 -64.7 1.02 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.323 1.049 . . . . 0.0 110.998 170.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -72.83 -19.03 61.4 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 -167.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -117.3 -28.37 6.17 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.493 1.517 . . . . 0.0 111.339 176.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.88 -41.04 91.23 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.042 0.829 . . . . 0.0 113.22 167.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.44 -43.68 84.96 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.054 0.927 . . . . 0.0 112.811 172.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.11 -17.21 63.22 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.353 1.461 . . . . 0.0 114.446 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -113.27 -13.87 12.9 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 172.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -66.76 -53.37 33.78 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.46 1.027 . . . . 0.0 111.001 160.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.1 p -62.56 -18.65 62.5 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.02 -14.63 60.9 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 171.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -145.62 -17.29 0.17 Allowed Glycine 0 CA--C 1.535 1.294 0 CA-C-O 118.021 -1.433 . . . . 0.0 115.975 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 68.29 19.45 9.0 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.502 1.921 . . . . 0.0 113.868 -165.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.31 43.98 15.61 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 125.375 1.47 . . . . 0.0 112.674 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.1 tpt85 -121.86 19.02 11.01 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.651 2.38 . . . . 0.0 111.341 -166.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.14 23.15 61.79 Favored Glycine 0 CA--C 1.532 1.141 0 CA-C-O 118.854 -0.97 . . . . 0.0 113.969 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.289 7.1 p 42.67 75.99 0.57 Allowed Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 127.043 2.137 . . . . 0.0 113.384 -176.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -40.61 -44.33 4.48 Favored 'Trans proline' 0 C--N 1.354 0.841 1 C-N-CA 125.643 4.229 . . . . 0.0 117.941 -167.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.584 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.99 -8.99 13.23 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 178.171 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.5 m -133.28 5.85 3.81 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.799 2.04 . . . . 0.0 113.217 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -66.88 138.97 95.43 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.577 1.151 . . . . 0.0 110.435 174.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -47.95 -40.1 32.73 Favored 'Trans proline' 0 CA--C 1.548 1.214 0 C-N-CA 123.278 2.652 . . . . 0.0 117.812 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -61.33 -19.47 64.19 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.36 2.707 . . . . 0.0 115.446 174.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -102.01 -1.7 31.23 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.119 1.368 . . . . 0.0 112.757 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.44 39.11 4.25 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.097 2.159 . . . . 0.0 115.595 175.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.1 mp 59.08 19.06 6.92 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.327 1.851 . . . . 0.0 114.097 -177.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.287 0 O-C-N 119.423 -2.048 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 120.435 0.16 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.474 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.8 t70 -114.04 -47.88 0.05 OUTLIER Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 125.135 1.374 . . . . 0.0 113.805 176.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.474 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 59.6 Cg_endo -74.16 -39.69 1.55 Allowed 'Trans proline' 0 C--N 1.357 1.02 0 CA-C-N 122.05 1.768 . . . . 0.0 112.957 176.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.87 35.22 1.42 Allowed 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 127.301 2.241 . . . . 0.0 114.822 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.35 -29.58 62.75 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.009 -1.057 . . . . 0.0 113.772 -175.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -146.72 0.38 0.76 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.564 1.146 . . . . 0.0 113.789 178.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.36 -33.87 70.04 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.309 1.044 . . . . 0.0 113.203 -177.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -89.66 -64.63 1.11 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.785 0.834 . . . . 0.0 110.852 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -73.67 -47.49 39.42 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.715 1.206 . . . . 0.0 114.024 -168.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -81.69 -29.66 32.94 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.564 0.746 . . . . 0.0 111.283 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.23 -44.68 89.08 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.058 0.837 . . . . 0.0 112.792 167.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.84 -47.06 82.29 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.031 0.915 . . . . 0.0 112.623 173.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -65.33 -17.2 64.33 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 177.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -115.87 -15.38 11.26 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 172.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 71.8 t-105 -66.44 -51.65 54.63 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.312 0.96 . . . . 0.0 111.179 162.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 82.8 p -62.87 -19.48 64.2 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.59 -13.72 59.63 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 172.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.98 -18.05 0.18 Allowed Glycine 0 CA--C 1.535 1.308 0 CA-C-O 117.724 -1.598 . . . . 0.0 116.11 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 60.96 21.85 12.11 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.43 1.492 . . . . 0.0 113.528 -164.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.97 31.92 2.61 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 125.968 1.707 . . . . 0.0 113.709 -170.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -93.78 -8.83 39.48 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.786 2.035 . . . . 0.0 113.084 -174.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.46 26.52 6.49 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.51 1.052 . . . . 0.0 113.325 -176.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.295 8.2 p 44.39 74.19 0.83 Allowed Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 127.45 2.3 . . . . 0.0 113.604 -177.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -41.91 -42.03 6.6 Favored 'Trans proline' 0 C--N 1.354 0.848 1 C-N-CA 125.375 4.05 . . . . 0.0 117.592 -171.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.585 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.1 -9.24 37.47 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 177.511 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 61.0 m -133.47 -0.64 3.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.929 2.092 . . . . 0.0 113.736 176.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -54.44 138.52 59.49 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 126.116 1.766 . . . . 0.0 111.256 174.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -46.17 -41.1 21.83 Favored 'Trans proline' 0 CA--C 1.547 1.172 0 C-N-CA 123.696 2.931 . . . . 0.0 117.967 -176.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -61.97 -22.61 74.61 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 123.328 2.685 . . . . 0.0 115.078 175.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -96.42 -10.58 27.25 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.764 1.226 . . . . 0.0 112.954 172.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.2 40.76 5.28 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.738 2.015 . . . . 0.0 115.317 176.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.1 mp 58.75 16.9 4.74 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.442 1.897 . . . . 0.0 114.703 -177.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.355 0 O-C-N 119.36 -2.088 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.703 0.287 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.585 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.8 t70 -134.47 -48.69 0.03 OUTLIER Pre-proline 0 CA--C 1.548 0.895 0 CA-C-O 117.319 -1.324 . . . . 0.0 113.461 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.585 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 57.9 Cg_endo -72.59 -36.45 5.01 Favored 'Trans proline' 0 C--N 1.356 0.922 0 CA-C-N 121.872 1.704 . . . . 0.0 112.984 175.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.24 38.01 3.13 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 127.361 2.264 . . . . 0.0 114.911 174.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 99.0 mt -74.57 -27.7 60.61 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -175.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -147.46 -1.43 0.62 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.674 1.19 . . . . 0.0 113.837 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.32 -34.11 68.4 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.057 -1.027 . . . . 0.0 113.235 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 -99.19 -63.07 1.16 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.349 1.059 . . . . 0.0 110.952 171.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptm85 -71.1 -37.88 72.37 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 -167.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -93.15 -30.15 15.38 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.209 1.004 . . . . 0.0 111.621 177.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.33 -44.3 76.0 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 123.757 0.694 . . . . 0.0 112.606 166.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.93 -46.88 87.38 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 117.966 0.883 . . . . 0.0 113.042 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -65.77 -14.09 60.68 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -119.31 -14.1 9.24 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -66.86 -49.08 66.81 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.8 1.182 . . . . 0.0 111.255 161.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 81.0 p -63.01 -15.68 57.25 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.29 -11.84 60.08 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 171.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.98 -20.1 0.06 OUTLIER Glycine 0 CA--C 1.533 1.189 0 CA-C-O 117.677 -1.624 . . . . 0.0 116.626 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 76.08 18.69 1.94 Allowed 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 127.689 2.395 . . . . 0.0 113.788 -167.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.09 44.97 19.5 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.139 1.376 . . . . 0.0 112.525 -170.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.3 tpt85 -123.93 17.06 9.35 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.934 2.494 . . . . 0.0 111.454 -165.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.68 22.06 62.68 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.452 1.025 . . . . 0.0 114.226 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.5 p 42.45 79.97 0.3 Allowed Pre-proline 0 N--CA 1.481 1.098 0 C-N-CA 127.055 2.142 . . . . 0.0 113.592 -174.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -40.6 -44.93 4.58 Favored 'Trans proline' 0 C--N 1.355 0.872 1 C-N-CA 125.659 4.24 . . . . 0.0 117.865 -169.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.606 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.0 -8.49 23.25 Favored 'General case' 0 CA--C 1.551 1.005 0 N-CA-C 115.705 1.742 . . . . 0.0 115.705 177.83 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.5 m -134.0 11.19 3.93 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 127.002 2.121 . . . . 0.0 113.017 176.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -65.89 141.01 97.43 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.401 1.081 . . . . 0.0 110.484 176.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -50.26 -40.05 52.35 Favored 'Trans proline' 0 CA--C 1.549 1.242 0 C-N-CA 122.713 2.275 . . . . 0.0 116.138 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -58.61 -20.39 49.95 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 124.258 3.305 . . . . 0.0 116.174 171.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -104.06 -3.95 23.89 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.377 1.471 . . . . 0.0 112.802 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.14 38.77 3.47 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.09 2.156 . . . . 0.0 115.286 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.8 mp 58.67 18.32 5.8 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.475 1.91 . . . . 0.0 114.195 -177.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.347 0 O-C-N 119.372 -2.08 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 110.505 -0.183 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -66.96 -48.07 51.58 Favored Pre-proline 0 CA--C 1.554 1.098 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 175.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.88 -35.85 1.3 Allowed 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 121.865 1.71 . . . . 0.0 113.496 -178.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 45.81 35.15 2.13 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 127.16 2.184 . . . . 0.0 114.886 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.4 mt -74.29 -27.39 60.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 -175.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -147.86 -4.55 0.49 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.81 -33.23 70.13 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.112 -0.992 . . . . 0.0 113.501 -176.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.2 mtm180 -87.51 -65.07 1.05 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.732 0.813 . . . . 0.0 110.749 172.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -73.2 -49.85 25.74 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.96 1.304 . . . . 0.0 114.014 -168.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -80.47 -30.05 37.46 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.75 0.82 . . . . 0.0 111.259 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.28 -44.4 89.37 Favored Glycine 0 CA--C 1.535 1.328 0 C-N-CA 123.896 0.76 . . . . 0.0 113.068 167.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.68 -46.84 80.69 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.164 0.982 . . . . 0.0 112.753 174.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -65.23 -14.72 61.34 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -118.52 -15.55 9.59 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 114.517 1.302 . . . . 0.0 114.517 172.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.3 t-105 -65.26 -50.6 65.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.588 1.085 . . . . 0.0 111.091 161.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.4 p -62.28 -20.52 64.38 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.04 -12.28 59.46 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 173.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -143.61 -20.39 0.2 Allowed Glycine 0 CA--C 1.536 1.355 0 CA-C-O 117.942 -1.476 . . . . 0.0 115.818 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 65.18 21.26 12.1 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.971 1.709 . . . . 0.0 113.842 -168.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.48 42.33 14.31 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.442 1.497 . . . . 0.0 112.879 -171.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.1 tpt85 -122.73 15.93 10.22 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 127.355 2.262 . . . . 0.0 111.68 -168.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.6 26.51 42.33 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 124.4 1.0 . . . . 0.0 114.238 174.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.6 p 43.46 74.29 0.8 Allowed Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.702 2.001 . . . . 0.0 113.205 -176.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -41.36 -43.5 5.65 Favored 'Trans proline' 0 C--N 1.354 0.841 1 C-N-CA 125.453 4.102 . . . . 0.0 117.727 -169.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.589 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.96 -9.54 22.25 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 178.093 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -133.2 5.65 3.82 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 126.577 1.951 . . . . 0.0 113.267 176.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -65.03 138.67 97.52 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.767 1.227 . . . . 0.0 110.608 174.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -47.61 -40.12 30.18 Favored 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 123.377 2.718 . . . . 0.0 117.653 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.02 -20.51 69.88 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.344 2.696 . . . . 0.0 115.23 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -99.02 -2.41 37.3 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.02 1.328 . . . . 0.0 112.707 172.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.71 37.66 3.54 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.08 2.152 . . . . 0.0 115.46 176.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp 58.34 19.34 6.27 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 126.422 1.889 . . . . 0.0 114.045 -177.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 O-C-N 119.489 -2.007 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 120.452 0.168 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.58 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 28.2 t70 -129.34 -47.28 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 125.334 1.454 . . . . 0.0 114.118 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.58 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 61.3 Cg_endo -73.35 -34.01 6.43 Favored 'Trans proline' 0 C--N 1.355 0.917 0 CA-C-N 122.037 1.763 . . . . 0.0 112.904 175.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 45.7 35.54 2.23 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 127.476 2.311 . . . . 0.0 115.014 173.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.71 -32.21 69.34 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -175.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -147.94 1.07 0.65 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.46 -34.19 68.74 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.046 -1.034 . . . . 0.0 113.246 -176.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -92.26 -65.09 1.03 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.832 0.853 . . . . 0.0 110.788 172.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -68.53 -49.41 59.78 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.783 1.233 . . . . 0.0 113.652 -168.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -83.36 -30.77 27.16 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.745 0.818 . . . . 0.0 111.365 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.46 -44.88 85.34 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.138 0.875 . . . . 0.0 113.011 169.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.36 -46.78 78.79 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.037 0.919 . . . . 0.0 112.83 174.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -64.71 -18.1 64.71 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 176.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -115.35 -13.14 11.68 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 173.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.4 t-105 -67.1 -53.23 32.77 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.451 1.023 . . . . 0.0 111.125 159.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.0 p -63.43 -18.82 64.13 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.76 -16.47 57.93 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.679 1.191 . . . . 0.0 114.126 171.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.98 -20.26 0.38 Allowed Glycine 0 CA--C 1.536 1.359 0 CA-C-O 118.15 -1.361 . . . . 0.0 115.335 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 70.68 20.74 5.58 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.66 1.984 . . . . 0.0 113.764 -166.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.76 42.99 16.54 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.392 1.477 . . . . 0.0 112.808 -172.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.8 tpt85 -120.61 8.8 10.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.77 2.428 . . . . 0.0 111.844 -166.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.52 21.95 59.27 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.581 1.086 . . . . 0.0 113.913 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.294 7.5 p 42.63 77.95 0.41 Allowed Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 127.121 2.168 . . . . 0.0 113.545 -177.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -39.87 -43.84 3.46 Favored 'Trans proline' 0 C--N 1.356 0.923 1 C-N-CA 125.954 4.436 . . . . 0.0 118.128 -166.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.615 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.92 -9.4 20.99 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.715 1.746 . . . . 0.0 115.715 178.293 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.3 m -134.75 7.48 3.51 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.677 1.991 . . . . 0.0 113.118 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -63.13 138.87 97.45 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.83 1.252 . . . . 0.0 111.011 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.45 -40.91 29.46 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 123.427 2.751 . . . . 0.0 117.526 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -63.45 -22.32 71.24 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.237 2.625 . . . . 0.0 115.1 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -95.95 -10.86 27.61 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.734 1.214 . . . . 0.0 112.863 172.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.08 42.54 6.68 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.879 2.071 . . . . 0.0 115.018 177.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.1 mp 61.13 14.78 5.73 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.576 1.951 . . . . 0.0 114.376 -178.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.343 0 O-C-N 119.31 -2.119 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.1 mmt180 . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -68.74 -47.56 32.69 Favored Pre-proline 0 CA--C 1.553 1.08 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 173.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.76 -36.9 1.38 Allowed 'Trans proline' 0 C--N 1.357 1.008 0 CA-C-N 121.868 1.703 . . . . 0.0 113.299 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 44.68 35.6 1.48 Allowed 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 127.429 2.292 . . . . 0.0 115.149 176.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -70.72 -32.48 69.68 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -148.08 1.9 0.66 Allowed 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 178.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.51 -33.68 68.29 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.207 1.003 . . . . 0.0 113.293 -177.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.9 mtm180 -93.58 -63.84 1.16 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.836 0.854 . . . . 0.0 110.965 172.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -68.75 -50.69 48.48 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.453 1.101 . . . . 0.0 113.669 -169.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -81.43 -31.12 33.27 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.705 0.802 . . . . 0.0 111.386 177.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.45 -43.7 90.28 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 123.996 0.808 . . . . 0.0 113.239 169.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.75 -45.66 77.85 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.219 1.01 . . . . 0.0 112.782 174.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -65.29 -15.29 62.36 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -117.77 -13.3 10.16 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 65.5 t-105 -65.37 -52.27 54.73 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.574 1.079 . . . . 0.0 110.911 158.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.1 p -62.66 -20.34 64.72 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.87 -14.87 56.84 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.05 -22.7 0.44 Allowed Glycine 0 CA--C 1.535 1.285 0 CA-C-O 118.198 -1.335 . . . . 0.0 115.089 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 70.4 21.8 5.52 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.571 1.948 . . . . 0.0 113.935 -167.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.79 43.44 17.04 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.328 1.451 . . . . 0.0 112.708 -172.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -120.83 13.42 11.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.763 2.425 . . . . 0.0 111.501 -166.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.3 25.24 48.66 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.344 0.973 . . . . 0.0 114.015 177.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.276 7.4 p 44.25 76.47 0.53 Allowed Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.705 2.002 . . . . 0.0 113.326 -177.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -41.82 -43.49 6.73 Favored 'Trans proline' 0 C--N 1.354 0.816 1 C-N-CA 125.31 4.007 . . . . 0.0 117.501 -170.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.591 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.25 -7.93 27.92 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 178.219 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.9 m -132.37 4.47 4.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.661 1.985 . . . . 0.0 113.31 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -65.18 138.65 97.34 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 124.986 1.314 . . . . 0.0 111.029 178.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -47.85 -41.01 32.46 Favored 'Trans proline' 0 CA--C 1.548 1.206 0 C-N-CA 123.488 2.792 . . . . 0.0 117.475 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.64 -20.8 71.9 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.342 2.695 . . . . 0.0 115.052 175.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -97.13 -3.15 41.64 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.918 1.287 . . . . 0.0 112.806 172.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 46.01 38.43 4.67 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.727 2.011 . . . . 0.0 115.028 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp 54.97 21.34 3.66 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 126.393 1.877 . . . . 0.0 115.022 -174.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 O-C-N 119.577 -1.952 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 110.811 -0.07 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -68.35 -48.06 36.1 Favored Pre-proline 0 CA--C 1.554 1.105 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 172.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -76.48 -42.2 0.38 Allowed 'Trans proline' 0 C--N 1.357 0.993 0 CA-C-N 121.924 1.723 . . . . 0.0 113.364 -178.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 44.74 33.93 1.07 Allowed 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 127.271 2.229 . . . . 0.0 114.907 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.4 mt -72.57 -31.02 64.91 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.985 -1.072 . . . . 0.0 113.601 -176.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -147.55 3.15 0.75 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.509 1.124 . . . . 0.0 113.891 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.83 -33.83 69.04 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.029 -1.044 . . . . 0.0 113.269 -176.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.9 mtm180 -91.63 -66.15 0.95 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.769 0.828 . . . . 0.0 110.813 172.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -67.23 -52.15 44.54 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.188 1.395 . . . . 0.0 113.792 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -80.94 -29.64 35.39 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.595 0.758 . . . . 0.0 111.48 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.9 -42.36 86.11 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.06 0.838 . . . . 0.0 113.209 168.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.02 -47.37 68.63 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.014 0.907 . . . . 0.0 112.927 173.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.93 -18.88 64.67 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.863 1.265 . . . . 0.0 114.368 175.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -112.66 -14.91 13.09 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 172.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -65.55 -52.68 50.63 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 119.41 1.004 . . . . 0.0 111.14 161.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.2 p -63.19 -20.83 65.77 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.65 -16.05 62.21 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 173.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -136.69 -18.97 0.67 Allowed Glycine 0 CA--C 1.536 1.347 0 CA-C-O 118.327 -1.263 . . . . 0.0 115.064 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 79.62 18.64 0.72 Allowed 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 127.89 2.476 . . . . 0.0 113.659 -167.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.14 45.69 19.66 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.117 1.367 . . . . 0.0 112.355 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.9 tpt85 -122.07 14.36 10.62 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.788 2.435 . . . . 0.0 111.657 -163.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.65 21.6 71.66 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-O 118.701 -1.055 . . . . 0.0 113.734 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.287 6.7 p 42.01 81.58 0.24 Allowed Pre-proline 0 N--CA 1.48 1.04 0 C-N-CA 127.406 2.283 . . . . 0.0 113.688 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -41.27 -43.43 5.43 Favored 'Trans proline' 0 C--N 1.354 0.839 1 C-N-CA 125.623 4.215 . . . . 0.0 118.085 -166.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.636 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.64 -7.74 22.61 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 178.306 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.5 m -127.95 -3.53 5.79 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.476 1.91 . . . . 0.0 113.4 175.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -62.2 137.28 95.79 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.18 1.392 . . . . 0.0 111.044 175.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.02 -39.64 33.07 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.481 2.787 . . . . 0.0 117.662 -178.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -61.61 -17.3 53.55 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.488 2.792 . . . . 0.0 115.516 174.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -107.25 2.27 24.53 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.395 1.478 . . . . 0.0 112.709 172.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 42.76 47.13 4.64 Favored 'General case' 0 CA--C 1.55 0.981 0 C-N-CA 127.353 2.261 . . . . 0.0 115.881 172.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 18.8 mt 57.92 18.76 5.25 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.808 1.643 . . . . 0.0 114.69 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 O-C-N 119.596 -1.94 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.56 0.219 . . . . 0.0 111.37 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.576 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 28.2 t70 -130.83 -47.9 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.983 0 C-N-CA 125.26 1.424 . . . . 0.0 114.138 -178.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.576 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 60.1 Cg_endo -73.2 -33.96 6.7 Favored 'Trans proline' 0 C--N 1.357 0.988 0 CA-C-N 122.211 1.825 . . . . 0.0 113.028 175.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.75 30.13 1.75 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.415 2.286 . . . . 0.0 115.355 175.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.15 -33.99 74.29 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.011 -1.056 . . . . 0.0 113.724 -175.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -149.04 2.17 0.57 Allowed 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.28 -36.37 68.53 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.415 1.086 . . . . 0.0 113.307 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.0 mtm180 -97.72 -62.89 1.18 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.141 0.976 . . . . 0.0 111.029 171.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -69.35 -40.86 77.25 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -168.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -91.3 -29.15 17.31 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.146 0.979 . . . . 0.0 111.418 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.52 -42.99 77.63 Favored Glycine 0 CA--C 1.538 1.483 0 C-N-CA 123.908 0.766 . . . . 0.0 112.946 167.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.23 -47.01 81.29 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 117.987 0.894 . . . . 0.0 113.083 174.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -65.57 -15.68 62.95 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.436 1.272 . . . . 0.0 114.436 176.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -115.8 -14.4 11.36 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 172.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -65.99 -51.95 53.83 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.529 1.059 . . . . 0.0 111.087 160.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.2 p -62.85 -19.0 63.7 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.83 -15.23 58.32 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.29 1.219 . . . . 0.0 114.29 172.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.04 -22.39 0.38 Allowed Glycine 0 CA--C 1.535 1.313 0 CA-C-O 118.291 -1.283 . . . . 0.0 115.211 177.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 74.24 20.06 2.74 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 127.104 2.162 . . . . 0.0 113.812 -167.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.77 44.17 17.6 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.173 1.389 . . . . 0.0 112.522 -171.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.6 tpt85 -121.68 12.83 10.72 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 127.724 2.41 . . . . 0.0 111.662 -165.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.46 22.82 57.88 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.576 1.084 . . . . 0.0 114.056 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.286 7.3 p 43.34 77.32 0.45 Allowed Pre-proline 0 N--CA 1.479 1.018 0 C-N-CA 126.866 2.067 . . . . 0.0 113.392 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -40.57 -43.57 4.29 Favored 'Trans proline' 0 C--N 1.355 0.881 1 C-N-CA 125.61 4.207 . . . . 0.0 117.985 -167.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.592 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.73 -9.48 20.44 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 178.03 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.3 m -134.08 6.14 3.61 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.688 1.995 . . . . 0.0 113.26 176.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -64.09 139.43 97.68 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 124.747 1.219 . . . . 0.0 110.704 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.19 -40.55 27.36 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 123.456 2.771 . . . . 0.0 117.623 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -62.34 -21.74 73.09 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.35 2.7 . . . . 0.0 115.194 174.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -98.44 -7.4 28.67 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.939 1.296 . . . . 0.0 112.782 172.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.79 40.92 4.62 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 127.028 2.131 . . . . 0.0 115.321 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.5 mp 59.95 16.75 6.03 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 126.468 1.907 . . . . 0.0 114.225 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.308 0 O-C-N 119.358 -2.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 110.826 -0.064 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -74.01 -47.67 6.36 Favored Pre-proline 0 CA--C 1.553 1.091 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 174.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.66 -32.73 2.64 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 121.915 1.743 . . . . 0.0 113.526 -176.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.95 31.56 2.42 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 127.257 2.223 . . . . 0.0 115.583 174.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.35 -34.74 75.04 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -173.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -148.44 0.78 0.6 Allowed 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.98 -34.98 70.55 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.39 1.076 . . . . 0.0 113.504 -176.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -91.49 -63.47 1.25 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.991 0.917 . . . . 0.0 111.013 172.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -73.25 -46.81 47.85 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.946 1.298 . . . . 0.0 114.044 -168.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -82.05 -27.64 32.9 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.597 0.759 . . . . 0.0 111.243 175.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.23 -43.31 84.09 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 123.977 0.799 . . . . 0.0 113.172 166.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.75 -44.98 80.04 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.142 0.971 . . . . 0.0 113.103 174.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -63.95 -15.36 59.01 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.036 1.334 . . . . 0.0 114.494 176.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -117.87 -10.84 10.37 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 172.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -68.0 -51.45 47.04 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.649 1.113 . . . . 0.0 111.065 158.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.8 p -63.18 -16.13 59.13 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.99 -13.73 58.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 171.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.14 -22.1 0.07 OUTLIER Glycine 0 CA--C 1.535 1.287 0 CA-C-O 117.929 -1.484 . . . . 0.0 116.122 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 69.21 20.65 7.46 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 126.765 2.026 . . . . 0.0 113.794 -166.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.47 42.85 15.08 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.32 1.448 . . . . 0.0 112.785 -171.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.8 tpt85 -116.79 12.73 14.91 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.626 2.371 . . . . 0.0 111.732 -167.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.87 20.91 60.34 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 124.588 1.09 . . . . 0.0 113.937 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.285 7.4 p 41.61 77.89 0.41 Allowed Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 126.989 2.115 . . . . 0.0 113.245 -175.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -41.17 -41.26 4.52 Favored 'Trans proline' 0 C--N 1.354 0.863 1 C-N-CA 125.883 4.389 . . . . 0.0 118.496 -165.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.585 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.29 -9.61 18.64 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 176.808 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 65.3 m -133.57 14.05 4.08 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.108 2.163 . . . . 0.0 112.917 177.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.58 140.35 96.45 Favored Pre-proline 0 CA--C 1.551 1.015 0 O-C-N 120.896 -1.128 . . . . 0.0 111.224 177.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -51.82 -39.97 66.89 Favored 'Trans proline' 0 CA--C 1.549 1.227 0 C-N-CA 122.941 2.427 . . . . 0.0 116.193 174.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -60.36 -21.63 68.04 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.484 2.79 . . . . 0.0 115.618 172.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -95.72 0.76 52.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.885 1.274 . . . . 0.0 112.629 171.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 47.03 33.95 2.56 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.909 2.084 . . . . 0.0 114.803 -177.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.3 mp 56.48 21.36 5.54 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.477 1.911 . . . . 0.0 114.008 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 O-C-N 119.481 -2.012 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 110.727 -0.101 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -70.57 -49.39 15.72 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 173.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -79.8 -34.89 0.84 Allowed 'Trans proline' 0 C--N 1.357 0.976 0 CA-C-N 121.874 1.705 . . . . 0.0 113.684 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 43.32 37.95 1.52 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 127.295 2.238 . . . . 0.0 113.982 -176.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.6 -39.3 77.35 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.494 1.118 . . . . 0.0 112.562 -171.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -143.99 2.67 1.19 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.812 1.245 . . . . 0.0 113.534 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.58 -32.85 69.33 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 120.969 -1.082 . . . . 0.0 113.414 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 -88.29 -66.75 0.88 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.789 0.836 . . . . 0.0 110.756 172.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -69.64 -53.7 17.46 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.223 1.409 . . . . 0.0 113.801 -169.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -77.44 -31.14 53.68 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.645 0.778 . . . . 0.0 111.427 177.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -57.2 -42.76 93.52 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.141 0.877 . . . . 0.0 113.364 169.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.78 -46.9 73.82 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.183 0.992 . . . . 0.0 112.776 173.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -64.52 -17.52 63.98 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 175.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -113.54 -13.31 12.79 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 172.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.8 t-105 -67.49 -51.8 46.85 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 119.475 1.034 . . . . 0.0 111.192 160.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.6 p -63.51 -17.9 63.25 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.422 1.268 . . . . 0.0 114.422 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.85 -16.17 57.45 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.681 1.192 . . . . 0.0 114.192 171.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -136.71 -24.17 0.48 Allowed Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.862 1.22 . . . . 0.0 114.85 175.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 73.0 18.66 3.89 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.986 2.114 . . . . 0.0 113.823 -165.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.63 43.66 16.6 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.242 1.417 . . . . 0.0 112.581 -170.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -117.57 10.47 13.48 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 127.502 2.321 . . . . 0.0 112.086 -165.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.96 21.52 65.52 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 118.805 -0.997 . . . . 0.0 113.676 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.288 7.2 p 40.16 78.54 0.36 Allowed Pre-proline 0 N--CA 1.48 1.05 0 C-N-CA 127.3 2.24 . . . . 0.0 113.513 -177.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -40.1 -41.86 3.24 Favored 'Trans proline' 0 C--N 1.355 0.897 1 C-N-CA 126.091 4.527 . . . . 0.0 118.71 -164.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.613 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.52 -9.33 12.55 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 177.283 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.9 m -129.32 9.17 5.59 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.517 1.927 . . . . 0.0 113.004 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -70.49 140.04 87.03 Favored Pre-proline 0 CA--C 1.551 0.992 0 O-C-N 120.94 -1.1 . . . . 0.0 111.301 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -51.3 -39.79 62.32 Favored 'Trans proline' 0 CA--C 1.548 1.207 0 C-N-CA 123.177 2.585 . . . . 0.0 116.511 175.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -60.07 -20.38 60.68 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.548 2.832 . . . . 0.0 115.709 172.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.16 2.16 42.73 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.045 1.338 . . . . 0.0 112.575 172.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 46.29 37.06 3.74 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.721 2.009 . . . . 0.0 114.653 -178.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.2 mp 57.81 20.64 6.72 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.413 1.885 . . . . 0.0 114.104 -176.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 O-C-N 119.33 -2.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 120.44 0.162 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.468 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.7 t70 -113.23 -48.15 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.085 1.354 . . . . 0.0 113.65 176.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 69.7 Cg_endo -75.7 -36.39 2.18 Favored 'Trans proline' 0 C--N 1.357 0.98 0 CA-C-N 122.049 1.767 . . . . 0.0 113.112 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 43.01 37.97 1.29 Allowed 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 127.544 2.337 . . . . 0.0 114.713 178.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 98.2 mt -70.91 -32.45 69.38 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -148.63 3.29 0.64 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.35 -34.15 68.51 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.025 -1.047 . . . . 0.0 113.195 -176.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 -91.99 -65.01 1.04 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.782 0.833 . . . . 0.0 111.033 171.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -68.69 -48.06 64.86 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.875 1.27 . . . . 0.0 114.153 -169.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -83.77 -29.53 27.35 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.803 0.841 . . . . 0.0 111.408 176.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.57 -41.93 89.72 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 123.999 0.809 . . . . 0.0 113.172 168.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.58 -45.68 78.46 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.142 0.971 . . . . 0.0 112.834 173.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.62 -17.28 63.87 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 175.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -114.17 -11.55 12.64 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 172.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 72.6 t-105 -68.4 -53.49 23.47 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.48 1.036 . . . . 0.0 110.995 158.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.9 p -63.63 -17.62 63.09 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.37 -16.37 54.18 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.325 1.232 . . . . 0.0 114.325 171.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.87 -18.78 0.18 Allowed Glycine 0 CA--C 1.535 1.288 0 CA-C-O 118.034 -1.426 . . . . 0.0 115.671 178.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 81.06 18.43 0.48 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 128.185 2.594 . . . . 0.0 113.575 -167.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.26 45.12 20.14 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.98 1.312 . . . . 0.0 112.44 -170.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -121.85 12.81 10.59 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 127.938 2.495 . . . . 0.0 111.736 -164.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.6 20.53 68.56 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.519 1.057 . . . . 0.0 114.003 -178.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.292 7.6 p 43.35 80.1 0.3 Allowed Pre-proline 0 N--CA 1.48 1.031 0 C-N-CA 127.167 2.187 . . . . 0.0 113.499 -176.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -41.04 -43.74 4.96 Favored 'Trans proline' 0 C--N 1.355 0.898 1 C-N-CA 125.721 4.281 . . . . 0.0 117.882 -167.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.602 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.53 -7.48 20.25 Favored 'General case' 0 CA--C 1.551 1.018 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 178.497 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 58.1 m -130.73 -3.24 4.16 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.475 1.91 . . . . 0.0 113.513 175.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.17 138.77 91.48 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 125.69 1.596 . . . . 0.0 111.498 178.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -46.93 -38.93 24.31 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 123.598 2.865 . . . . 0.0 117.997 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -63.17 -20.66 71.47 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.365 2.71 . . . . 0.0 115.171 173.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -103.44 -13.29 16.68 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.147 1.379 . . . . 0.0 112.888 172.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.37 51.43 7.68 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 127.103 2.161 . . . . 0.0 115.039 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 32.9 mt 61.15 12.62 4.18 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 126.36 1.864 . . . . 0.0 114.899 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 O-C-N 119.538 -1.977 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 120.896 0.379 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.563 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 26.9 t70 -131.89 -48.43 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.309 1.444 . . . . 0.0 113.93 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.563 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 57.1 Cg_endo -72.95 -38.47 2.89 Favored 'Trans proline' 0 C--N 1.356 0.923 0 CA-C-N 122.137 1.799 . . . . 0.0 112.801 174.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.58 36.22 2.46 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 127.309 2.244 . . . . 0.0 114.645 176.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.9 mt -76.4 -24.35 54.05 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -176.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -147.36 -1.62 0.62 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.28 -33.36 69.34 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.028 -1.045 . . . . 0.0 113.413 -177.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -92.27 -65.01 1.04 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.912 0.885 . . . . 0.0 110.975 171.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -71.38 -34.57 70.54 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -168.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -99.27 -27.36 13.82 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.474 1.109 . . . . 0.0 111.337 176.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.4 -40.02 75.32 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.753 0.692 . . . . 0.0 112.894 164.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.53 -46.19 87.17 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.083 0.941 . . . . 0.0 112.933 172.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -65.69 -11.62 46.7 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.966 1.306 . . . . 0.0 114.334 174.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -120.63 -11.72 9.01 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 70.8 t-105 -65.3 -50.17 66.71 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.664 1.12 . . . . 0.0 110.91 159.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.5 p -62.03 -16.63 53.23 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.19 -13.9 61.01 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 171.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.06 -16.53 0.1 OUTLIER Glycine 0 CA--C 1.536 1.394 0 CA-C-O 117.874 -1.514 . . . . 0.0 116.14 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 75.01 18.62 2.5 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 127.323 2.249 . . . . 0.0 113.958 -166.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.78 45.21 18.37 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.392 1.477 . . . . 0.0 112.385 -171.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 tpt85 -124.93 15.06 8.56 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 127.963 2.505 . . . . 0.0 111.638 -163.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.3 16.83 68.13 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.724 1.154 . . . . 0.0 114.195 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.303 6.8 p 44.81 80.08 0.31 Allowed Pre-proline 0 N--CA 1.479 1.013 0 C-N-CA 127.07 2.148 . . . . 0.0 113.124 -173.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -41.72 -43.39 6.49 Favored 'Trans proline' 0 C--N 1.356 0.921 1 C-N-CA 125.553 4.169 . . . . 0.0 118.125 -169.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.619 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.59 -6.56 20.73 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 177.754 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.4 m -133.06 12.58 4.28 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.968 2.107 . . . . 0.0 112.956 176.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -68.66 141.1 92.47 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.829 1.251 . . . . 0.0 111.1 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -52.84 -40.37 75.13 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 123.237 2.625 . . . . 0.0 115.222 172.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -56.85 -19.21 30.57 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.937 3.091 . . . . 0.0 116.463 169.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -106.47 2.83 26.63 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.155 1.382 . . . . 0.0 112.829 173.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.64 47.19 8.62 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.775 2.03 . . . . 0.0 114.676 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.9 mt 62.3 14.04 6.45 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 126.462 1.905 . . . . 0.0 114.894 -177.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.347 0 O-C-N 119.49 -2.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.547 0.213 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.541 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.0 t70 -129.56 -48.95 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.201 1.4 . . . . 0.0 113.733 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.541 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.0 Cg_endo -73.4 -38.71 2.42 Favored 'Trans proline' 0 C--N 1.357 1.011 0 CA-C-N 122.034 1.762 . . . . 0.0 112.745 174.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.72 34.69 1.87 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 127.294 2.238 . . . . 0.0 114.669 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.4 mt -76.25 -26.22 55.77 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -147.49 0.62 0.69 Allowed 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 -177.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.24 -37.21 69.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.364 1.065 . . . . 0.0 113.212 -177.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -95.3 -62.82 1.24 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.759 0.824 . . . . 0.0 111.095 169.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -71.23 -30.35 66.24 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 -167.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -102.81 -28.8 11.85 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.799 1.24 . . . . 0.0 111.333 174.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.3 -41.97 81.21 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.741 0.686 . . . . 0.0 112.948 166.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.55 -44.95 96.12 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.06 0.93 . . . . 0.0 113.021 174.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -66.64 -13.5 61.25 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 176.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -117.77 -13.69 10.15 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 171.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 -66.71 -50.03 64.13 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.668 1.122 . . . . 0.0 110.924 159.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.5 p -63.93 -13.74 48.09 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.3 -12.14 59.36 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 170.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.97 -23.89 0.06 OUTLIER Glycine 0 CA--C 1.535 1.302 0 CA-C-O 117.786 -1.563 . . . . 0.0 116.16 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 67.68 22.03 9.12 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.396 1.879 . . . . 0.0 113.718 -167.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.18 42.01 16.68 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.437 1.495 . . . . 0.0 113.043 -172.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.2 tpt85 -120.29 8.49 10.86 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.509 2.324 . . . . 0.0 112.102 -168.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.6 20.83 53.24 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.774 1.178 . . . . 0.0 114.212 176.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.296 7.2 p 43.5 77.68 0.43 Allowed Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 126.82 2.048 . . . . 0.0 113.441 -174.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -41.18 -42.82 5.1 Favored 'Trans proline' 0 C--N 1.355 0.91 1 C-N-CA 125.724 4.283 . . . . 0.0 118.051 -168.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.58 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -65.25 -9.48 24.28 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 177.957 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.9 m -134.09 11.96 3.91 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.659 1.984 . . . . 0.0 112.91 176.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -64.37 140.82 98.05 Favored Pre-proline 0 CA--C 1.548 0.881 0 O-C-N 120.885 -1.134 . . . . 0.0 111.089 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -53.15 -41.51 71.57 Favored 'Trans proline' 0 CA--C 1.55 1.322 0 C-N-CA 122.424 2.083 . . . . 0.0 115.482 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -54.83 -22.22 28.91 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 124.222 3.281 . . . . 0.0 116.764 169.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -100.19 -6.17 26.53 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.572 1.149 . . . . 0.0 113.114 173.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 44.87 45.48 8.51 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.359 1.864 . . . . 0.0 114.595 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.2 mt 64.05 11.08 5.88 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 126.859 2.063 . . . . 0.0 115.16 -177.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.395 0 O-C-N 119.523 -1.986 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 120.625 0.25 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.527 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.4 t70 -135.45 -49.86 0.02 OUTLIER Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.086 1.355 . . . . 0.0 113.684 178.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.527 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 59.7 Cg_endo -73.58 -34.2 5.91 Favored 'Trans proline' 0 C--N 1.358 1.034 0 CA-C-N 121.975 1.741 . . . . 0.0 113.035 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 43.54 38.35 1.83 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 127.508 2.323 . . . . 0.0 114.195 178.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.85 -30.67 62.8 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.272 1.029 . . . . 0.0 113.23 -173.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -145.54 -0.77 0.83 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.92 -33.54 68.9 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.029 -1.045 . . . . 0.0 113.365 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.7 mtm180 -89.43 -63.78 1.24 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.563 0.745 . . . . 0.0 110.902 170.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -72.08 -43.84 64.21 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.267 1.427 . . . . 0.0 114.568 -169.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -88.22 -27.05 22.05 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.998 0.919 . . . . 0.0 111.48 175.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.24 -43.0 89.31 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 123.612 0.625 . . . . 0.0 112.76 165.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.17 -44.21 92.77 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.048 0.924 . . . . 0.0 112.988 173.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.97 -15.52 62.32 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -119.7 -15.43 8.93 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 172.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -67.05 -50.38 62.1 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.387 0.994 . . . . 0.0 111.125 162.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.1 p -63.32 -19.59 64.74 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.9 -14.14 58.85 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 172.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -140.32 -20.23 0.36 Allowed Glycine 0 CA--C 1.535 1.318 0 CA-C-O 118.008 -1.44 . . . . 0.0 115.377 178.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 76.41 21.99 1.32 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 127.355 2.262 . . . . 0.0 113.675 -167.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.34 43.52 19.34 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.152 1.381 . . . . 0.0 112.649 -172.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -122.54 9.61 9.65 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.84 2.456 . . . . 0.0 111.887 -164.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.44 21.76 53.22 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.592 1.091 . . . . 0.0 114.233 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.294 7.1 p 43.83 76.01 0.58 Allowed Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 126.804 2.042 . . . . 0.0 113.235 -176.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -40.72 -43.21 4.42 Favored 'Trans proline' 0 C--N 1.355 0.877 1 C-N-CA 125.763 4.309 . . . . 0.0 117.974 -167.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.605 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.03 -9.87 18.61 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.185 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.0 m -131.81 3.29 4.11 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.3 1.84 . . . . 0.0 113.464 175.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -64.95 138.87 97.62 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 124.95 1.3 . . . . 0.0 111.17 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -47.63 -40.36 30.51 Favored 'Trans proline' 0 CA--C 1.548 1.213 0 C-N-CA 123.651 2.901 . . . . 0.0 117.705 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -61.65 -20.61 69.51 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.411 2.74 . . . . 0.0 115.202 174.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -99.52 -2.53 35.62 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.925 1.29 . . . . 0.0 112.776 172.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.81 38.69 4.55 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.755 2.022 . . . . 0.0 115.137 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.0 mp 58.12 18.98 5.66 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.337 1.855 . . . . 0.0 114.484 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 O-C-N 119.398 -2.063 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 120.6 0.238 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.533 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.0 t70 -128.41 -48.51 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.235 1.414 . . . . 0.0 113.816 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.533 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.7 Cg_endo -73.49 -38.84 2.29 Favored 'Trans proline' 0 C--N 1.356 0.921 0 CA-C-N 122.086 1.781 . . . . 0.0 112.71 174.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 45.43 34.92 1.71 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 127.315 2.246 . . . . 0.0 114.728 177.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.5 mt -75.56 -26.15 57.71 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.04 -1.037 . . . . 0.0 113.704 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -147.89 -0.93 0.6 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -178.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.86 -34.77 70.1 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.096 -1.002 . . . . 0.0 113.325 -176.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.2 mtm180 -91.11 -65.51 1.01 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.69 0.796 . . . . 0.0 110.834 170.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -69.82 -40.03 76.13 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.238 1.415 . . . . 0.0 114.538 -168.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -93.63 -29.59 15.38 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.393 1.077 . . . . 0.0 111.249 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.46 -41.33 80.47 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 123.876 0.75 . . . . 0.0 113.184 168.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.14 -48.11 79.85 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 118.072 0.936 . . . . 0.0 112.807 173.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -64.32 -13.85 52.56 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -121.75 -19.0 6.94 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 171.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -62.0 -47.58 84.15 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.624 1.102 . . . . 0.0 111.308 164.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.0 p -61.97 -24.96 67.33 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.14 -5.91 42.25 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -132.7 -26.81 0.62 Allowed Glycine 0 CA--C 1.535 1.333 0 C-N-CA 124.941 1.258 . . . . 0.0 114.558 177.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 63.44 25.81 14.66 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.396 1.478 . . . . 0.0 113.802 -169.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 48.44 40.72 15.48 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.667 1.587 . . . . 0.0 113.339 -173.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -113.12 11.96 18.99 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 127.167 2.187 . . . . 0.0 111.969 -171.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.96 26.02 35.85 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 118.911 -0.938 . . . . 0.0 113.921 175.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.283 8.8 p 43.63 72.95 1.04 Allowed Pre-proline 0 N--CA 1.48 1.028 0 C-N-CA 126.644 1.978 . . . . 0.0 113.359 -177.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -41.54 -41.81 5.62 Favored 'Trans proline' 0 C--N 1.355 0.881 1 C-N-CA 125.64 4.227 . . . . 0.0 117.9 -168.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.613 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.27 -10.1 21.62 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 115.666 1.728 . . . . 0.0 115.666 177.629 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.9 m -133.36 3.26 3.61 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.222 1.809 . . . . 0.0 113.666 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -61.86 138.75 95.57 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 125.02 1.328 . . . . 0.0 111.148 176.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -47.01 -40.86 26.22 Favored 'Trans proline' 0 CA--C 1.548 1.217 0 C-N-CA 123.64 2.893 . . . . 0.0 117.79 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.47 -21.14 72.39 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.24 2.626 . . . . 0.0 115.043 175.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -97.29 -6.63 33.98 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.859 1.263 . . . . 0.0 112.81 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 45.34 40.26 5.15 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 126.964 2.105 . . . . 0.0 115.104 177.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.1 mp 55.5 19.54 3.24 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 126.564 1.945 . . . . 0.0 115.007 -175.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 O-C-N 119.395 -2.066 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 120.588 0.233 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.54 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 27.4 t70 -132.19 -49.09 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.993 0 CA-C-O 117.208 -1.377 . . . . 0.0 113.845 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.54 ' HD2' ' H ' ' A' ' 2' ' ' ASP . 58.2 Cg_endo -73.18 -38.25 2.86 Favored 'Trans proline' 0 C--N 1.357 0.997 0 CA-C-N 122.14 1.8 . . . . 0.0 112.729 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.45 33.31 1.89 Allowed 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 127.244 2.218 . . . . 0.0 114.799 175.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.3 mt -73.69 -28.2 61.62 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.074 -1.016 . . . . 0.0 113.563 -176.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -148.06 2.08 0.67 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.52 -36.21 68.93 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 121.118 -0.988 . . . . 0.0 113.182 -177.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 -91.89 -65.28 1.02 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.557 0.743 . . . . 0.0 110.86 170.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -66.77 -46.06 76.53 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.862 1.265 . . . . 0.0 114.205 -169.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -88.72 -30.16 19.29 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.128 0.971 . . . . 0.0 111.407 177.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -56.33 -42.67 89.26 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 123.889 0.757 . . . . 0.0 113.17 170.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.64 -46.27 83.22 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.074 0.937 . . . . 0.0 112.833 173.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -65.01 -16.61 63.64 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 176.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -116.27 -13.41 11.08 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 172.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -67.46 -52.01 44.48 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.489 1.041 . . . . 0.0 111.021 160.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.2 p -62.56 -19.22 63.46 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.45 -13.82 53.64 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 171.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -143.55 -21.46 0.19 Allowed Glycine 0 CA--C 1.535 1.289 0 CA-C-O 117.836 -1.536 . . . . 0.0 115.722 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 70.02 20.7 6.42 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.427 1.891 . . . . 0.0 113.524 -165.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.82 37.02 6.54 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.571 1.549 . . . . 0.0 113.106 -171.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 48.5 tpt85 -102.71 -13.62 17.0 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.514 2.326 . . . . 0.0 113.059 -169.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.74 21.29 8.75 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.947 1.261 . . . . 0.0 113.759 -175.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.299 7.7 p 44.86 80.23 0.3 Allowed Pre-proline 0 N--CA 1.48 1.055 0 C-N-CA 127.345 2.258 . . . . 0.0 113.783 -177.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -42.66 -42.33 8.5 Favored 'Trans proline' 0 C--N 1.354 0.862 1 C-N-CA 125.57 4.18 . . . . 0.0 117.961 -170.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.61 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -67.77 -5.94 18.71 Favored 'General case' 0 CA--C 1.551 1.018 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.621 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 75.4 m -134.33 12.26 3.84 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 127.221 2.208 . . . . 0.0 112.713 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -65.26 143.59 98.82 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 125.066 1.346 . . . . 0.0 111.931 -177.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -52.57 -39.6 74.75 Favored 'Trans proline' 0 CA--C 1.548 1.212 0 C-N-CA 123.041 2.494 . . . . 0.0 116.214 173.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -60.02 -20.54 61.14 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.668 2.912 . . . . 0.0 115.602 170.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -99.02 6.67 46.54 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.449 1.5 . . . . 0.0 112.321 171.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 48.46 32.63 3.44 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 127.202 2.201 . . . . 0.0 115.123 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.14 28.65 9.25 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 125.587 1.555 . . . . 0.0 113.597 -174.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.349 0 O-C-N 119.326 -2.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -68.13 -49.63 33.95 Favored Pre-proline 0 CA--C 1.554 1.108 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 175.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.48 -42.97 0.19 Allowed 'Trans proline' 0 C--N 1.356 0.948 0 CA-C-N 121.845 1.695 . . . . 0.0 113.461 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.2 32.86 1.58 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 126.968 2.107 . . . . 0.0 114.396 -176.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.6 mt -79.01 -22.51 45.38 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -177.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -146.57 -1.89 0.68 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.18 -35.21 69.31 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.338 1.055 . . . . 0.0 113.297 -177.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.7 mtm180 -96.18 -65.75 0.95 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.936 0.894 . . . . 0.0 110.969 169.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -68.89 -19.26 64.22 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -167.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -120.9 -33.56 3.73 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.677 1.591 . . . . 0.0 111.297 176.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.64 -41.26 97.3 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.077 0.846 . . . . 0.0 113.813 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.94 -40.22 79.12 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 118.488 1.144 . . . . 0.0 112.682 174.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -64.64 -17.9 64.45 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.212 1.405 . . . . 0.0 114.617 176.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -111.27 -14.97 13.73 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 173.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 70.9 t-105 -67.56 -52.43 38.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.571 1.078 . . . . 0.0 110.906 160.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.3 p -63.32 -19.15 64.35 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.1 -16.92 61.57 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 171.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -134.41 -21.03 0.77 Allowed Glycine 0 CA--C 1.535 1.338 0 CA-C-O 118.209 -1.329 . . . . 0.0 114.895 176.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 74.96 19.16 2.43 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.094 2.157 . . . . 0.0 113.625 -167.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 47.92 43.38 17.54 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.211 1.405 . . . . 0.0 112.569 -170.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -121.03 8.22 10.4 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.593 2.357 . . . . 0.0 112.11 -165.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.44 21.44 58.36 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.567 1.08 . . . . 0.0 114.044 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . 0.293 7.1 p 40.47 77.95 0.4 Allowed Pre-proline 0 N--CA 1.481 1.105 0 C-N-CA 127.086 2.154 . . . . 0.0 113.411 -177.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -40.05 -42.26 3.29 Favored 'Trans proline' 0 C--N 1.356 0.949 1 C-N-CA 126.032 4.488 . . . . 0.0 118.481 -163.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.615 ' H ' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -62.92 -8.88 7.95 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.71 1.745 . . . . 0.0 115.71 177.56 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.5 m -127.46 7.57 6.39 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.298 1.839 . . . . 0.0 113.107 176.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -74.15 142.12 78.56 Favored Pre-proline 0 CA--C 1.554 1.116 0 O-C-N 120.909 -1.12 . . . . 0.0 111.477 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -51.58 -38.42 65.08 Favored 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 123.35 2.7 . . . . 0.0 116.992 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -60.06 -20.4 60.68 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.609 2.873 . . . . 0.0 115.447 171.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -102.29 10.0 39.51 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.437 1.495 . . . . 0.0 112.059 171.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 48.47 33.46 4.01 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.129 2.172 . . . . 0.0 115.068 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 54.65 29.52 11.7 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.512 1.525 . . . . 0.0 113.503 -175.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 O-C-N 119.344 -2.098 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_