data_3tgf_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 3tgf _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 4' ' ' HIS . . . . . . . . . . . . . 8.9 t60 . . . . . 0 CA--C 1.552 1.025 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -87.01 -69.1 0.7 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.871 1.268 . . . . 0.0 110.149 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.416 ' ND2' ' H ' ' A' ' 7' ' ' ASP . 25.8 t-20 -137.73 154.05 49.67 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 116.019 1.859 . . . . 0.0 116.019 176.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.416 ' H ' ' ND2' ' A' ' 6' ' ' ASN . 41.7 m-20 -166.02 95.47 0.59 Allowed 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 110.329 -3.123 . . . . 0.0 109.17 158.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 33.0 t -113.78 140.56 24.84 Favored Pre-proline 0 CA--C 1.55 0.972 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -173.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -57.91 172.25 1.26 Allowed 'Trans proline' 0 N--CA 1.481 0.778 0 C-N-CA 124.325 3.35 . . . . 0.0 112.246 160.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -125.33 -47.16 1.75 Allowed 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 116.351 1.982 . . . . 0.0 116.351 175.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 56.8 p -67.63 93.49 0.37 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.137 0.975 . . . . 0.0 110.879 167.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 2.4 t60 52.21 99.02 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 124.004 1.859 . . . . 0.0 111.398 -149.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.0 t -83.68 47.1 1.23 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 112.06 -2.336 . . . . 0.0 111.817 -176.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 64.89 -46.82 0.34 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.872 2.069 . . . . 0.0 116.375 -172.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -90.76 -52.22 4.98 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.093 1.357 . . . . 0.0 112.797 172.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.6 m -117.7 148.54 41.89 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -166.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -63.37 -59.6 4.48 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 114.807 -1.088 . . . . 0.0 113.651 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -115.26 63.45 0.68 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 123.362 1.553 . . . . 0.0 111.242 175.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.63 164.77 16.64 Favored Glycine 0 N--CA 1.476 1.302 0 CA-C-N 111.789 -2.459 . . . . 0.0 111.058 175.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.9 p -125.26 95.48 4.49 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 112.815 -1.693 . . . . 0.0 109.47 169.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.94 141.52 28.51 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.754 2.131 . . . . 0.0 116.754 -163.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -85.94 81.28 8.58 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 112.13 -2.305 . . . . 0.0 107.261 157.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -69.52 89.91 0.53 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 112.587 -2.097 . . . . 0.0 107.945 163.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 76.2 mt -64.2 88.55 0.05 Allowed 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 112.753 -2.021 . . . . 0.0 108.753 172.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 84.0 t -55.71 -48.97 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-N 112.304 -2.225 . . . . 0.0 110.95 -166.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -26.61 66.31 Favored 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -92.84 -15.54 26.36 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 126.786 2.034 . . . . 0.0 115.186 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 p30 55.55 34.26 22.77 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.947 2.499 . . . . 0.0 115.876 -167.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -118.37 109.98 39.79 Favored Pre-proline 0 N--CA 1.486 1.357 0 CA-C-N 114.022 -1.445 . . . . 0.0 113.135 -172.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -88.22 128.48 2.24 Favored 'Trans proline' 0 N--CA 1.481 0.735 0 C-N-CA 121.151 1.234 . . . . 0.0 113.774 170.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -139.7 145.54 38.49 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 114.776 -1.102 . . . . 0.0 113.532 168.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.0 m -112.5 143.38 43.75 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -148.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.3 t -94.32 101.89 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-N 113.334 -1.757 . . . . 0.0 106.977 155.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.4 m -57.26 140.14 50.72 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 177.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -56.47 160.55 3.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 121.806 0.813 . . . . 0.0 112.566 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.9 p -53.02 107.81 0.26 Allowed 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 114.272 -1.331 . . . . 0.0 112.779 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.14 26.41 52.66 Favored Glycine 0 N--CA 1.484 1.835 0 CA-C-N 114.108 -1.406 . . . . 0.0 115.318 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -117.77 153.07 34.05 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.814 0.846 . . . . 0.0 113.178 172.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.5 m -121.2 165.98 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -111.03 -142.08 8.92 Favored Glycine 0 CA--C 1.535 1.313 0 N-CA-C 119.001 2.36 . . . . 0.0 119.001 -129.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.16 -75.09 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 126.595 1.958 . . . . 0.0 112.109 -154.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.8 ttt180 -113.32 30.23 7.37 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.974 176.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 34.5 m 23.48 62.93 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 128.492 2.717 . . . . 0.0 113.527 -175.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -93.11 -26.48 17.43 Favored 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 113.471 -1.695 . . . . 0.0 112.473 -176.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 43.4 m-70 -115.2 146.9 40.96 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -156.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.58 151.82 32.19 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.517 0.675 . . . . 0.0 111.946 164.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.5 t70 . . . . . 0 N--CA 1.479 1.001 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.065 179.733 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 63.3 m80 . . . . . 0 N--CA 1.471 0.604 0 CA-C-O 121.267 0.556 . . . . 0.0 111.394 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -95.69 121.9 37.88 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 114.288 -1.324 . . . . 0.0 113.031 175.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -114.36 174.76 5.79 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 113.996 -1.457 . . . . 0.0 113.336 172.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -69.84 103.11 2.11 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 121.159 0.504 . . . . 0.0 111.788 173.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.5 p -48.32 120.01 8.1 Favored Pre-proline 0 N--CA 1.481 1.099 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -164.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.69 98.23 1.04 Allowed 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 122.176 1.917 . . . . 0.0 110.261 153.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -102.42 100.96 11.14 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 114.068 -1.424 . . . . 0.0 111.861 171.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 p -125.64 -89.71 0.56 Allowed 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 113.576 -1.647 . . . . 0.0 110.687 172.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.43 ' CD2' ' H ' ' A' ' 13' ' ' THR . 1.4 p-80 -55.78 -40.92 73.3 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.563 1.145 . . . . 0.0 111.696 158.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.43 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 4.1 p -73.63 34.1 0.08 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 128.636 2.774 . . . . 0.0 115.102 171.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -77.49 70.32 3.86 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 123.793 1.758 . . . . 0.0 113.019 169.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -65.49 -43.98 88.49 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 110.912 -2.858 . . . . 0.0 109.135 162.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 67.1 m -124.47 151.15 44.94 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -178.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -103.3 -75.64 0.61 Allowed 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 111.609 -2.541 . . . . 0.0 109.537 174.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -96.86 52.5 1.18 Allowed 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 123.18 1.467 . . . . 0.0 109.89 177.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.59 105.29 0.53 Allowed Glycine 0 CA--C 1.525 0.678 0 CA-C-N 112.224 -2.262 . . . . 0.0 110.515 -175.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.2 p -71.01 91.59 0.89 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 171.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 p -95.83 143.43 27.06 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 112.077 -2.329 . . . . 0.0 117.061 -166.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.16 105.46 16.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 111.493 -2.594 . . . . 0.0 110.101 177.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -80.39 96.85 6.82 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 112.992 -1.913 . . . . 0.0 110.872 -174.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.7 mt -69.93 93.42 0.77 Allowed 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 112.804 -1.998 . . . . 0.0 110.752 172.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.5 t -48.55 -52.0 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 126.105 1.762 . . . . 0.0 111.458 -169.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.9 mp0 -60.07 -17.87 42.62 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 -176.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -113.0 -11.37 13.39 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.784 1.634 . . . . 0.0 114.536 177.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 t70 54.62 30.23 12.88 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 127.976 2.51 . . . . 0.0 114.269 -164.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -97.32 111.91 59.55 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 113.737 -1.574 . . . . 0.0 112.805 -167.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -79.58 95.41 1.04 Allowed 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.081 2.521 . . . . 0.0 109.429 170.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -97.18 128.72 44.33 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-O 121.949 0.881 . . . . 0.0 110.921 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.8 m -110.97 136.6 49.73 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -149.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 61.9 t -92.79 103.43 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 160.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 96.6 m -59.84 131.5 51.07 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.555 170.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.3 m170 -56.11 137.13 52.0 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.691 0.619 . . . . 0.0 109.591 174.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 t -59.42 103.4 0.19 Allowed 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 121.519 0.676 . . . . 0.0 110.862 175.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.99 -13.32 5.52 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 114.183 -1.371 . . . . 0.0 115.971 -162.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -129.64 151.29 50.41 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.07 0.948 . . . . 0.0 113.026 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.1 m -122.72 166.0 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 113.79 -1.55 . . . . 0.0 112.407 164.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 124.54 151.44 8.1 Favored Glycine 0 N--CA 1.475 1.288 0 CA-C-N 113.674 -1.603 . . . . 0.0 111.164 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.04 73.56 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 117.458 0.629 . . . . 0.0 111.596 172.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.34 -4.86 59.06 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.359 1.464 . . . . 0.0 112.683 174.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 68.7 m 44.33 81.63 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.113 1.765 . . . . 0.0 114.298 -173.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -142.08 -31.84 0.53 Allowed 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 112.674 -2.057 . . . . 0.0 116.329 -178.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -83.58 104.49 13.75 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 -169.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.67 108.98 1.54 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -172.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.0 t0 . . . . . 0 CA--C 1.547 0.838 0 CA-C-N 111.894 -2.412 . . . . 0.0 105.165 177.923 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -134.81 57.65 1.8 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.287 1.435 . . . . 0.0 110.83 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -77.61 131.45 37.8 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 114.652 -1.158 . . . . 0.0 113.288 -165.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -49.64 106.83 0.12 Allowed 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.708 173.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 23.6 m -48.27 121.59 9.34 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.524 1.529 . . . . 0.0 114.733 -165.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -78.49 82.31 2.51 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 N-CA-C 107.262 -1.861 . . . . 0.0 107.262 157.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -60.7 106.22 0.54 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -164.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 m -168.0 101.75 0.46 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 127.471 2.309 . . . . 0.0 109.009 165.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 70.66 -39.36 0.44 Allowed 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 126.191 1.796 . . . . 0.0 112.871 -161.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.9 p -62.16 55.48 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 127.131 2.172 . . . . 0.0 112.49 157.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -125.13 -71.71 0.7 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.798 1.639 . . . . 0.0 112.698 -174.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 7.6 t80 51.61 -25.79 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 118.27 2.692 . . . . 0.0 118.27 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.8 m -117.3 165.5 13.39 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.538 1.135 . . . . 0.0 113.985 170.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -86.82 -78.43 0.29 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 113.392 -1.731 . . . . 0.0 110.073 171.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -100.13 57.38 0.96 Allowed 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 122.937 1.351 . . . . 0.0 108.91 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -149.49 98.66 0.19 Allowed Glycine 0 CA--C 1.526 0.74 0 CA-C-N 112.235 -2.257 . . . . 0.0 111.519 -174.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.4 p -71.4 94.6 1.26 Allowed 'General case' 0 C--N 1.317 -0.846 0 O-C-N 125.411 1.3 . . . . 0.0 110.15 -177.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.4 p -74.5 149.65 40.19 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 -169.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -112.09 122.02 46.58 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 112.486 -2.143 . . . . 0.0 109.035 166.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -84.4 105.16 15.02 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 113.073 -1.876 . . . . 0.0 111.71 -174.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.7 91.45 2.91 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 112.942 -1.936 . . . . 0.0 109.996 175.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.3 t -52.52 -60.12 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 125.17 1.388 . . . . 0.0 111.171 -169.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.408 ' H ' ' CD ' ' A' ' 26' ' ' GLN . 4.3 pm0 -55.34 -14.68 1.97 Allowed 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 116.999 2.222 . . . . 0.0 116.999 177.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -113.38 -7.66 13.47 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 125.049 1.34 . . . . 0.0 114.199 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.6 p30 52.21 29.25 6.35 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 127.647 2.379 . . . . 0.0 115.244 -170.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -119.03 122.6 29.5 Favored Pre-proline 0 N--CA 1.476 0.852 0 CA-C-N 113.51 -1.677 . . . . 0.0 112.361 -166.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -74.65 133.4 17.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.066 1.844 . . . . 0.0 109.894 160.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -133.98 140.84 47.0 Favored 'General case' 0 N--CA 1.483 1.179 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.513 168.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 60.1 m -108.67 137.75 46.1 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -152.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.2 t -81.73 92.88 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 CA-C-N 113.381 -1.736 . . . . 0.0 106.773 158.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 79.1 m -55.43 129.26 38.01 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.441 171.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 26.5 m170 -55.64 155.91 5.26 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.644 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.9 m -40.09 105.82 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 125.342 1.457 . . . . 0.0 114.264 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.15 10.44 83.79 Favored Glycine 0 CA--C 1.541 1.713 0 CA-C-N 113.757 -1.565 . . . . 0.0 116.298 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -90.26 134.54 34.24 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 122.713 1.244 . . . . 0.0 113.163 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.0 m -110.74 159.78 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-N 113.013 -1.903 . . . . 0.0 112.141 169.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.2 151.52 8.76 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 113.265 -1.789 . . . . 0.0 111.529 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.57 -33.63 76.03 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 115.067 -0.566 . . . . 0.0 111.87 175.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.63 6.86 44.14 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.205 1.402 . . . . 0.0 111.873 177.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 60.6 m 38.05 75.28 0.07 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.727 2.011 . . . . 0.0 113.056 -170.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -120.92 -35.07 3.41 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 113.487 -1.688 . . . . 0.0 115.197 -171.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -105.95 103.13 12.56 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 -163.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.71 114.67 6.51 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.45 1.119 . . . . 0.0 111.37 175.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.2 t0 . . . . . 0 N--CA 1.473 0.722 0 CA-C-N 112.723 -2.035 . . . . 0.0 110.884 -165.797 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.4 t60 . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 121.236 0.541 . . . . 0.0 112.442 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -114.25 -28.17 7.36 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 116.618 2.081 . . . . 0.0 116.618 -171.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 p30 38.79 -104.39 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -173.45 136.84 0.62 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.734 2.014 . . . . 0.0 110.536 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.7 p -73.64 137.45 77.27 Favored Pre-proline 0 N--CA 1.485 1.292 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -76.36 -179.61 5.45 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.408 2.739 . . . . 0.0 113.701 165.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -51.74 -41.4 61.52 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 -175.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.412 ' HG ' ' CE1' ' A' ' 12' ' ' HIS . 37.0 p -51.64 -33.43 33.39 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.764 1.269 . . . . 0.0 113.979 173.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.412 ' CE1' ' HG ' ' A' ' 11' ' ' SER . 15.8 m-70 -106.85 -24.46 12.05 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.055 -1.429 . . . . 0.0 114.018 -168.161 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.3 p -63.98 -29.05 70.24 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 155.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -85.41 -12.46 51.98 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 117.465 2.395 . . . . 0.0 117.465 172.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -68.54 -62.02 1.57 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.255 146.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 80.5 m -91.86 80.33 5.24 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.043 0.925 . . . . 0.0 112.218 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -56.91 -52.04 66.73 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 114.162 -1.381 . . . . 0.0 113.348 -169.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -117.54 49.04 1.26 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 123.142 1.449 . . . . 0.0 110.029 167.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -130.97 115.22 1.72 Allowed Glycine 0 N--CA 1.479 1.51 0 CA-C-N 112.632 -2.076 . . . . 0.0 110.279 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.6 p -74.62 80.28 2.0 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 113.943 -1.129 . . . . 0.0 109.776 170.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 p -77.56 147.66 35.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 112.237 -2.256 . . . . 0.0 116.958 -166.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -118.13 123.06 44.65 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 111.996 -2.366 . . . . 0.0 110.325 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -84.07 85.54 7.33 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 123.472 1.606 . . . . 0.0 109.304 178.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.5 mt -71.41 89.41 0.92 Allowed 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 112.151 -2.295 . . . . 0.0 111.957 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 14.1 t -58.06 -44.71 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 CA-C-N 112.842 -1.981 . . . . 0.0 111.581 -161.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.0 pm0 -56.89 -22.2 35.4 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.968 2.21 . . . . 0.0 116.968 178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -115.33 1.32 13.72 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.4 p30 49.57 29.44 3.0 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.418 2.687 . . . . 0.0 115.353 -166.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -97.04 109.08 47.53 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 113.318 -1.764 . . . . 0.0 112.947 -165.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -83.9 48.78 2.65 Favored 'Trans proline' 0 N--CA 1.488 1.185 0 C-N-CA 122.714 2.276 . . . . 0.0 113.725 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.81 148.85 32.74 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -165.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.0 m -82.87 143.32 30.84 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.254 -1.339 . . . . 0.0 113.083 -165.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.4 t -100.74 102.07 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 152.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 98.9 m -57.58 134.7 56.37 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 120.96 0.41 . . . . 0.0 111.888 177.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -56.51 164.22 1.49 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 114.406 -1.27 . . . . 0.0 111.758 174.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.6 p -51.09 107.77 0.2 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.075 1.35 . . . . 0.0 113.414 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.4 20.49 62.16 Favored Glycine 0 CA--C 1.543 1.804 0 CA-C-N 113.988 -1.46 . . . . 0.0 115.569 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -107.49 153.09 23.33 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 174.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 m -119.56 165.21 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 177.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -104.77 -148.2 17.7 Favored Glycine 0 N--CA 1.476 1.333 0 N-CA-C 119.234 2.454 . . . . 0.0 119.234 -129.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.73 -67.72 0.06 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 111.604 -2.298 . . . . 0.0 113.683 -160.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.75 ' CZ ' ' HE2' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -110.87 -3.62 15.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.861 1.664 . . . . 0.0 114.922 174.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 33.5 m 45.61 68.08 0.64 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 126.136 1.775 . . . . 0.0 111.471 -176.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -120.65 22.38 11.21 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-O 122.568 1.175 . . . . 0.0 111.072 172.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.75 ' HE2' ' CZ ' ' A' ' 42' ' ' ARG . 16.4 m-70 -140.51 144.59 36.07 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 -165.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.0 142.87 34.97 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.6 0.563 . . . . 0.0 111.322 174.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 t70 . . . . . 0 N--CA 1.48 1.038 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.761 -177.734 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 CA--C 1.548 0.873 0 CA-C-O 122.225 1.012 . . . . 0.0 113.149 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 49.7 t 61.08 109.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 CA-C-N 113.027 -1.897 . . . . 0.0 110.826 177.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.0 p -42.21 -56.66 2.82 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 -162.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -49.24 -39.38 30.04 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.964 1.306 . . . . 0.0 114.375 176.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -87.01 -69.1 0.7 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.871 1.268 . . . . 0.0 110.149 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.416 ' ND2' ' H ' ' A' ' 7' ' ' ASP . 25.8 t-20 -137.73 154.05 49.67 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 116.019 1.859 . . . . 0.0 116.019 176.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.416 ' H ' ' ND2' ' A' ' 6' ' ' ASN . 41.7 m-20 -166.02 95.47 0.59 Allowed 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 110.329 -3.123 . . . . 0.0 109.17 158.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 33.0 t -113.78 140.56 24.84 Favored Pre-proline 0 CA--C 1.55 0.972 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -173.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -57.91 172.25 1.26 Allowed 'Trans proline' 0 N--CA 1.481 0.778 0 C-N-CA 124.325 3.35 . . . . 0.0 112.246 160.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -125.33 -47.16 1.75 Allowed 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 116.351 1.982 . . . . 0.0 116.351 175.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 56.8 p -67.63 93.49 0.37 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.137 0.975 . . . . 0.0 110.879 167.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 2.4 t60 52.21 99.02 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 124.004 1.859 . . . . 0.0 111.398 -149.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.0 t -83.68 47.1 1.23 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 112.06 -2.336 . . . . 0.0 111.817 -176.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 64.89 -46.82 0.34 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.872 2.069 . . . . 0.0 116.375 -172.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -90.76 -52.22 4.98 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.093 1.357 . . . . 0.0 112.797 172.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.6 m -117.7 148.54 41.89 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -166.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -63.37 -59.6 4.48 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 114.807 -1.088 . . . . 0.0 113.651 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -115.26 63.45 0.68 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 123.362 1.553 . . . . 0.0 111.242 175.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.63 164.77 16.64 Favored Glycine 0 N--CA 1.476 1.302 0 CA-C-N 111.789 -2.459 . . . . 0.0 111.058 175.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.9 p -125.26 95.48 4.49 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 112.815 -1.693 . . . . 0.0 109.47 169.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.94 141.52 28.51 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.754 2.131 . . . . 0.0 116.754 -163.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -85.94 81.28 8.58 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 112.13 -2.305 . . . . 0.0 107.261 157.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -69.52 89.91 0.53 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 112.587 -2.097 . . . . 0.0 107.945 163.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 76.2 mt -64.2 88.55 0.05 Allowed 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 112.753 -2.021 . . . . 0.0 108.753 172.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 84.0 t -55.71 -48.97 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-N 112.304 -2.225 . . . . 0.0 110.95 -166.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -26.61 66.31 Favored 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -92.84 -15.54 26.36 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 126.786 2.034 . . . . 0.0 115.186 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 p30 55.55 34.26 22.77 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.947 2.499 . . . . 0.0 115.876 -167.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -118.37 109.98 39.79 Favored Pre-proline 0 N--CA 1.486 1.357 0 CA-C-N 114.022 -1.445 . . . . 0.0 113.135 -172.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -88.22 128.48 2.24 Favored 'Trans proline' 0 N--CA 1.481 0.735 0 C-N-CA 121.151 1.234 . . . . 0.0 113.774 170.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -139.7 145.54 38.49 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 114.776 -1.102 . . . . 0.0 113.532 168.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.0 m -112.5 143.38 43.75 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -148.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.3 t -94.32 101.89 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-N 113.334 -1.757 . . . . 0.0 106.977 155.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.4 m -57.26 140.14 50.72 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 177.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -56.47 160.55 3.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 121.806 0.813 . . . . 0.0 112.566 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.9 p -53.02 107.81 0.26 Allowed 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 114.272 -1.331 . . . . 0.0 112.779 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.14 26.41 52.66 Favored Glycine 0 N--CA 1.484 1.835 0 CA-C-N 114.108 -1.406 . . . . 0.0 115.318 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -117.77 153.07 34.05 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.814 0.846 . . . . 0.0 113.178 172.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.5 m -121.2 165.98 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -111.03 -142.08 8.92 Favored Glycine 0 CA--C 1.535 1.313 0 N-CA-C 119.001 2.36 . . . . 0.0 119.001 -129.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.16 -75.09 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 126.595 1.958 . . . . 0.0 112.109 -154.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.8 ttt180 -113.32 30.23 7.37 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.974 176.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 34.5 m 23.48 62.93 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 128.492 2.717 . . . . 0.0 113.527 -175.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -93.11 -26.48 17.43 Favored 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 113.471 -1.695 . . . . 0.0 112.473 -176.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 43.4 m-70 -115.2 146.9 40.96 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -156.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.58 151.82 32.19 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.517 0.675 . . . . 0.0 111.946 164.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -59.11 100.31 0.07 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.065 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 31.1 tp 82.13 -44.87 0.16 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 112.156 -2.293 . . . . 0.0 112.359 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.0 mp -83.11 54.47 2.78 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.125 1.77 . . . . 0.0 110.088 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.333 0 CA-C-O 115.998 -1.953 . . . . 0.0 116.202 -171.873 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 115.598 1.703 . . . . 0.0 115.598 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 43.4 t -65.08 100.12 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.186 1.394 . . . . 0.0 109.388 -174.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.5 p -152.69 -76.12 0.13 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -170.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 63.3 m80 -87.89 92.56 9.17 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.267 0.556 . . . . 0.0 111.394 -167.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -95.69 121.9 37.88 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 114.288 -1.324 . . . . 0.0 113.031 175.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -114.36 174.76 5.79 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 113.996 -1.457 . . . . 0.0 113.336 172.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -69.84 103.11 2.11 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 121.159 0.504 . . . . 0.0 111.788 173.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.5 p -48.32 120.01 8.1 Favored Pre-proline 0 N--CA 1.481 1.099 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -164.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.69 98.23 1.04 Allowed 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 122.176 1.917 . . . . 0.0 110.261 153.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -102.42 100.96 11.14 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 114.068 -1.424 . . . . 0.0 111.861 171.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 p -125.64 -89.71 0.56 Allowed 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 113.576 -1.647 . . . . 0.0 110.687 172.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.43 ' CD2' ' H ' ' A' ' 13' ' ' THR . 1.4 p-80 -55.78 -40.92 73.3 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.563 1.145 . . . . 0.0 111.696 158.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.43 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 4.1 p -73.63 34.1 0.08 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 128.636 2.774 . . . . 0.0 115.102 171.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -77.49 70.32 3.86 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 123.793 1.758 . . . . 0.0 113.019 169.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -65.49 -43.98 88.49 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 110.912 -2.858 . . . . 0.0 109.135 162.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 67.1 m -124.47 151.15 44.94 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -178.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -103.3 -75.64 0.61 Allowed 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 111.609 -2.541 . . . . 0.0 109.537 174.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -96.86 52.5 1.18 Allowed 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 123.18 1.467 . . . . 0.0 109.89 177.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.59 105.29 0.53 Allowed Glycine 0 CA--C 1.525 0.678 0 CA-C-N 112.224 -2.262 . . . . 0.0 110.515 -175.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.2 p -71.01 91.59 0.89 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 171.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 p -95.83 143.43 27.06 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 112.077 -2.329 . . . . 0.0 117.061 -166.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.16 105.46 16.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 111.493 -2.594 . . . . 0.0 110.101 177.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -80.39 96.85 6.82 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 112.992 -1.913 . . . . 0.0 110.872 -174.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.7 mt -69.93 93.42 0.77 Allowed 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 112.804 -1.998 . . . . 0.0 110.752 172.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.5 t -48.55 -52.0 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 126.105 1.762 . . . . 0.0 111.458 -169.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.9 mp0 -60.07 -17.87 42.62 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 -176.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -113.0 -11.37 13.39 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.784 1.634 . . . . 0.0 114.536 177.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 t70 54.62 30.23 12.88 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 127.976 2.51 . . . . 0.0 114.269 -164.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -97.32 111.91 59.55 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 113.737 -1.574 . . . . 0.0 112.805 -167.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -79.58 95.41 1.04 Allowed 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.081 2.521 . . . . 0.0 109.429 170.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -97.18 128.72 44.33 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-O 121.949 0.881 . . . . 0.0 110.921 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.8 m -110.97 136.6 49.73 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -149.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 61.9 t -92.79 103.43 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 160.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 96.6 m -59.84 131.5 51.07 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.555 170.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.3 m170 -56.11 137.13 52.0 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.691 0.619 . . . . 0.0 109.591 174.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 t -59.42 103.4 0.19 Allowed 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 121.519 0.676 . . . . 0.0 110.862 175.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.99 -13.32 5.52 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 114.183 -1.371 . . . . 0.0 115.971 -162.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -129.64 151.29 50.41 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.07 0.948 . . . . 0.0 113.026 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.1 m -122.72 166.0 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 113.79 -1.55 . . . . 0.0 112.407 164.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 124.54 151.44 8.1 Favored Glycine 0 N--CA 1.475 1.288 0 CA-C-N 113.674 -1.603 . . . . 0.0 111.164 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.04 73.56 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 117.458 0.629 . . . . 0.0 111.596 172.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.34 -4.86 59.06 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.359 1.464 . . . . 0.0 112.683 174.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 68.7 m 44.33 81.63 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.113 1.765 . . . . 0.0 114.298 -173.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -142.08 -31.84 0.53 Allowed 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 112.674 -2.057 . . . . 0.0 116.329 -178.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -83.58 104.49 13.75 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 -169.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.67 108.98 1.54 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -172.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -108.48 87.13 2.42 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 111.894 -2.412 . . . . 0.0 105.165 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 61.2 mt -74.41 64.18 1.12 Allowed 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 118.249 2.685 . . . . 0.0 118.249 -152.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -85.82 46.0 1.27 Allowed 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 112.984 -1.916 . . . . 0.0 110.809 166.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-N 113.737 -1.574 . . . . 0.0 114.837 -174.066 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.484 1.246 0 CA-C-O 122.635 1.207 . . . . 0.0 113.23 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.1 t -49.22 -45.21 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 CA-C-N 113.271 -1.786 . . . . 0.0 113.249 -168.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.2 t -48.63 -41.28 30.6 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -66.08 -23.81 66.59 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -134.81 57.65 1.8 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.287 1.435 . . . . 0.0 110.83 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -77.61 131.45 37.8 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 114.652 -1.158 . . . . 0.0 113.288 -165.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -49.64 106.83 0.12 Allowed 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.708 173.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 23.6 m -48.27 121.59 9.34 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.524 1.529 . . . . 0.0 114.733 -165.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -78.49 82.31 2.51 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 N-CA-C 107.262 -1.861 . . . . 0.0 107.262 157.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -60.7 106.22 0.54 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -164.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 m -168.0 101.75 0.46 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 127.471 2.309 . . . . 0.0 109.009 165.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 70.66 -39.36 0.44 Allowed 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 126.191 1.796 . . . . 0.0 112.871 -161.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.9 p -62.16 55.48 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 127.131 2.172 . . . . 0.0 112.49 157.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -125.13 -71.71 0.7 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.798 1.639 . . . . 0.0 112.698 -174.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 7.6 t80 51.61 -25.79 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 118.27 2.692 . . . . 0.0 118.27 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.8 m -117.3 165.5 13.39 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.538 1.135 . . . . 0.0 113.985 170.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -86.82 -78.43 0.29 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 113.392 -1.731 . . . . 0.0 110.073 171.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -100.13 57.38 0.96 Allowed 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 122.937 1.351 . . . . 0.0 108.91 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -149.49 98.66 0.19 Allowed Glycine 0 CA--C 1.526 0.74 0 CA-C-N 112.235 -2.257 . . . . 0.0 111.519 -174.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.4 p -71.4 94.6 1.26 Allowed 'General case' 0 C--N 1.317 -0.846 0 O-C-N 125.411 1.3 . . . . 0.0 110.15 -177.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.4 p -74.5 149.65 40.19 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 -169.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -112.09 122.02 46.58 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 112.486 -2.143 . . . . 0.0 109.035 166.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -84.4 105.16 15.02 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 113.073 -1.876 . . . . 0.0 111.71 -174.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.7 91.45 2.91 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 112.942 -1.936 . . . . 0.0 109.996 175.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.3 t -52.52 -60.12 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 125.17 1.388 . . . . 0.0 111.171 -169.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.408 ' H ' ' CD ' ' A' ' 26' ' ' GLN . 4.3 pm0 -55.34 -14.68 1.97 Allowed 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 116.999 2.222 . . . . 0.0 116.999 177.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -113.38 -7.66 13.47 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 125.049 1.34 . . . . 0.0 114.199 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.6 p30 52.21 29.25 6.35 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 127.647 2.379 . . . . 0.0 115.244 -170.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -119.03 122.6 29.5 Favored Pre-proline 0 N--CA 1.476 0.852 0 CA-C-N 113.51 -1.677 . . . . 0.0 112.361 -166.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -74.65 133.4 17.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.066 1.844 . . . . 0.0 109.894 160.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -133.98 140.84 47.0 Favored 'General case' 0 N--CA 1.483 1.179 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.513 168.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 60.1 m -108.67 137.75 46.1 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -152.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.2 t -81.73 92.88 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 CA-C-N 113.381 -1.736 . . . . 0.0 106.773 158.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 79.1 m -55.43 129.26 38.01 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.441 171.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 26.5 m170 -55.64 155.91 5.26 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.644 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.9 m -40.09 105.82 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 125.342 1.457 . . . . 0.0 114.264 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.15 10.44 83.79 Favored Glycine 0 CA--C 1.541 1.713 0 CA-C-N 113.757 -1.565 . . . . 0.0 116.298 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -90.26 134.54 34.24 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 122.713 1.244 . . . . 0.0 113.163 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.0 m -110.74 159.78 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-N 113.013 -1.903 . . . . 0.0 112.141 169.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.2 151.52 8.76 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 113.265 -1.789 . . . . 0.0 111.529 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.57 -33.63 76.03 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 115.067 -0.566 . . . . 0.0 111.87 175.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.63 6.86 44.14 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.205 1.402 . . . . 0.0 111.873 177.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 60.6 m 38.05 75.28 0.07 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.727 2.011 . . . . 0.0 113.056 -170.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -120.92 -35.07 3.41 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 113.487 -1.688 . . . . 0.0 115.197 -171.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -105.95 103.13 12.56 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 -163.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.71 114.67 6.51 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.45 1.119 . . . . 0.0 111.37 175.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -77.36 96.63 4.68 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 112.723 -2.035 . . . . 0.0 110.884 -165.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.6 mt -47.32 -37.03 10.17 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 170.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.6 mt -91.94 66.79 5.1 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 123.151 1.453 . . . . 0.0 108.256 171.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.39 0 CA-C-N 112.314 -2.221 . . . . 0.0 114.867 178.632 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 122.868 1.318 . . . . 0.0 114.079 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.8 t -78.72 97.93 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.823 -174.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.0 p -66.07 85.76 0.09 Allowed 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 114.41 -1.268 . . . . 0.0 112.837 174.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -162.52 155.07 19.3 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 114.166 -1.379 . . . . 0.0 112.442 -178.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -114.25 -28.17 7.36 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 116.618 2.081 . . . . 0.0 116.618 -171.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 p30 38.79 -104.39 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -173.45 136.84 0.62 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.734 2.014 . . . . 0.0 110.536 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.7 p -73.64 137.45 77.27 Favored Pre-proline 0 N--CA 1.485 1.292 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -76.36 -179.61 5.45 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.408 2.739 . . . . 0.0 113.701 165.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -51.74 -41.4 61.52 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 -175.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.412 ' HG ' ' CE1' ' A' ' 12' ' ' HIS . 37.0 p -51.64 -33.43 33.39 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.764 1.269 . . . . 0.0 113.979 173.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.412 ' CE1' ' HG ' ' A' ' 11' ' ' SER . 15.8 m-70 -106.85 -24.46 12.05 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.055 -1.429 . . . . 0.0 114.018 -168.161 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.3 p -63.98 -29.05 70.24 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 155.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -85.41 -12.46 51.98 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 117.465 2.395 . . . . 0.0 117.465 172.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -68.54 -62.02 1.57 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.255 146.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 80.5 m -91.86 80.33 5.24 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.043 0.925 . . . . 0.0 112.218 -176.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -56.91 -52.04 66.73 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 114.162 -1.381 . . . . 0.0 113.348 -169.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -117.54 49.04 1.26 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 123.142 1.449 . . . . 0.0 110.029 167.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -130.97 115.22 1.72 Allowed Glycine 0 N--CA 1.479 1.51 0 CA-C-N 112.632 -2.076 . . . . 0.0 110.279 178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.6 p -74.62 80.28 2.0 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 113.943 -1.129 . . . . 0.0 109.776 170.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.3 p -77.56 147.66 35.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 112.237 -2.256 . . . . 0.0 116.958 -166.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -118.13 123.06 44.65 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 111.996 -2.366 . . . . 0.0 110.325 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -84.07 85.54 7.33 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 123.472 1.606 . . . . 0.0 109.304 178.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.5 mt -71.41 89.41 0.92 Allowed 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 112.151 -2.295 . . . . 0.0 111.957 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 14.1 t -58.06 -44.71 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 CA-C-N 112.842 -1.981 . . . . 0.0 111.581 -161.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.0 pm0 -56.89 -22.2 35.4 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.968 2.21 . . . . 0.0 116.968 178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -115.33 1.32 13.72 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.4 p30 49.57 29.44 3.0 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.418 2.687 . . . . 0.0 115.353 -166.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -97.04 109.08 47.53 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 113.318 -1.764 . . . . 0.0 112.947 -165.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -83.9 48.78 2.65 Favored 'Trans proline' 0 N--CA 1.488 1.185 0 C-N-CA 122.714 2.276 . . . . 0.0 113.725 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.81 148.85 32.74 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -165.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.0 m -82.87 143.32 30.84 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.254 -1.339 . . . . 0.0 113.083 -165.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.4 t -100.74 102.07 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 152.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 98.9 m -57.58 134.7 56.37 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 120.96 0.41 . . . . 0.0 111.888 177.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -56.51 164.22 1.49 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 114.406 -1.27 . . . . 0.0 111.758 174.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.6 p -51.09 107.77 0.2 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.075 1.35 . . . . 0.0 113.414 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.4 20.49 62.16 Favored Glycine 0 CA--C 1.543 1.804 0 CA-C-N 113.988 -1.46 . . . . 0.0 115.569 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -107.49 153.09 23.33 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 174.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 m -119.56 165.21 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 177.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -104.77 -148.2 17.7 Favored Glycine 0 N--CA 1.476 1.333 0 N-CA-C 119.234 2.454 . . . . 0.0 119.234 -129.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 61.73 -67.72 0.06 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 111.604 -2.298 . . . . 0.0 113.683 -160.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.75 ' CZ ' ' HE2' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -110.87 -3.62 15.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.861 1.664 . . . . 0.0 114.922 174.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 33.5 m 45.61 68.08 0.64 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 126.136 1.775 . . . . 0.0 111.471 -176.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -120.65 22.38 11.21 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-O 122.568 1.175 . . . . 0.0 111.072 172.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.75 ' HE2' ' CZ ' ' A' ' 42' ' ' ARG . 16.4 m-70 -140.51 144.59 36.07 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 -165.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.0 142.87 34.97 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.6 0.563 . . . . 0.0 111.322 174.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -73.91 83.98 1.71 Allowed 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.761 -177.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.8 mt -73.56 76.46 1.47 Allowed 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 113.655 -1.611 . . . . 0.0 111.404 173.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -170.77 -60.05 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 111.842 -2.436 . . . . 0.0 107.66 -172.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.09 0 CA-C-O 117.127 -1.416 . . . . 0.0 113.321 166.297 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 8.9 t60 . . . . . 0 CA--C 1.552 1.025 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -87.01 -69.1 0.7 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.871 1.268 . . . . 0.0 110.149 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.414 ' HA ' HG23 ' A' ' 25' ' ' VAL . 46.2 t30 -137.73 154.05 49.67 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 116.019 1.859 . . . . 0.0 116.019 176.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -166.02 95.47 0.59 Allowed 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 110.329 -3.123 . . . . 0.0 109.17 158.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 33.0 t -113.78 140.56 24.84 Favored Pre-proline 0 CA--C 1.55 0.972 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -173.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -57.91 172.25 1.26 Allowed 'Trans proline' 0 N--CA 1.481 0.778 0 C-N-CA 124.325 3.35 . . . . 0.0 112.246 160.189 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -125.33 -47.16 1.75 Allowed 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 116.351 1.982 . . . . 0.0 116.351 175.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 56.8 p -67.63 93.49 0.37 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.137 0.975 . . . . 0.0 110.879 167.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 2.4 t60 52.21 99.02 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 124.004 1.859 . . . . 0.0 111.398 -149.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.472 HG22 ' O ' ' A' ' 16' ' ' CYS . 3.0 t -83.68 47.1 1.23 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 112.06 -2.336 . . . . 0.0 111.817 -176.094 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 64.89 -46.82 0.34 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.872 2.069 . . . . 0.0 116.375 -172.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -90.76 -52.22 4.98 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.093 1.357 . . . . 0.0 112.797 172.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.472 ' O ' HG22 ' A' ' 13' ' ' THR . 38.6 m -117.7 148.54 41.89 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -166.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -63.37 -59.6 4.48 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 114.807 -1.088 . . . . 0.0 113.651 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -115.26 63.45 0.68 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 123.362 1.553 . . . . 0.0 111.242 175.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.63 164.77 16.64 Favored Glycine 0 N--CA 1.476 1.302 0 CA-C-N 111.789 -2.459 . . . . 0.0 111.058 175.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.9 p -125.26 95.48 4.49 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 112.815 -1.693 . . . . 0.0 109.47 169.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.48 ' SG ' ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -87.94 141.52 28.51 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.754 2.131 . . . . 0.0 116.754 -163.003 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -85.94 81.28 8.58 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 112.13 -2.305 . . . . 0.0 107.261 157.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.48 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 26.5 t80 -69.52 89.91 0.53 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 112.587 -2.097 . . . . 0.0 107.945 163.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 76.2 mt -64.2 88.55 0.05 Allowed 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 112.753 -2.021 . . . . 0.0 108.753 172.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.414 HG23 ' HA ' ' A' ' 6' ' ' ASN . 84.0 t -55.71 -48.97 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-N 112.304 -2.225 . . . . 0.0 110.95 -166.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -26.61 66.31 Favored 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -92.84 -15.54 26.36 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 126.786 2.034 . . . . 0.0 115.186 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 p30 55.55 34.26 22.77 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.947 2.499 . . . . 0.0 115.876 -167.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -118.37 109.98 39.79 Favored Pre-proline 0 N--CA 1.486 1.357 0 CA-C-N 114.022 -1.445 . . . . 0.0 113.135 -172.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 96.5 Cg_endo -88.22 128.48 2.24 Favored 'Trans proline' 0 N--CA 1.481 0.735 0 C-N-CA 121.151 1.234 . . . . 0.0 113.774 170.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -139.7 145.54 38.49 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 114.776 -1.102 . . . . 0.0 113.532 168.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.0 m -112.5 143.38 43.75 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -148.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.3 t -94.32 101.89 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-N 113.334 -1.757 . . . . 0.0 106.977 155.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.4 m -57.26 140.14 50.72 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 177.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -56.47 160.55 3.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 121.806 0.813 . . . . 0.0 112.566 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.9 p -53.02 107.81 0.26 Allowed 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 114.272 -1.331 . . . . 0.0 112.779 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.14 26.41 52.66 Favored Glycine 0 N--CA 1.484 1.835 0 CA-C-N 114.108 -1.406 . . . . 0.0 115.318 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -117.77 153.07 34.05 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.814 0.846 . . . . 0.0 113.178 172.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.646 HG23 ' HB2' ' A' ' 45' ' ' HIS . 8.5 m -121.2 165.98 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -111.03 -142.08 8.92 Favored Glycine 0 CA--C 1.535 1.313 0 N-CA-C 119.001 2.36 . . . . 0.0 119.001 -129.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.16 -75.09 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 126.595 1.958 . . . . 0.0 112.109 -154.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.8 ttt180 -113.32 30.23 7.37 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.974 176.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 16' ' ' CYS . 34.5 m 23.48 62.93 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 128.492 2.717 . . . . 0.0 113.527 -175.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -93.11 -26.48 17.43 Favored 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 113.471 -1.695 . . . . 0.0 112.473 -176.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.646 ' HB2' HG23 ' A' ' 39' ' ' VAL . 43.4 m-70 -115.2 146.9 40.96 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -156.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.58 151.82 32.19 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.517 0.675 . . . . 0.0 111.946 164.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.5 t70 . . . . . 0 N--CA 1.479 1.001 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.065 179.733 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.405 ' O ' HG23 ' A' ' 25' ' ' VAL . 63.3 m80 . . . . . 0 N--CA 1.471 0.604 0 CA-C-O 121.267 0.556 . . . . 0.0 111.394 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.528 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . 44.9 p90 -95.69 121.9 37.88 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 114.288 -1.324 . . . . 0.0 113.031 175.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -114.36 174.76 5.79 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 113.996 -1.457 . . . . 0.0 113.336 172.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -69.84 103.11 2.11 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 121.159 0.504 . . . . 0.0 111.788 173.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 23' ' ' PHE . 26.5 p -48.32 120.01 8.1 Favored Pre-proline 0 N--CA 1.481 1.099 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -164.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.488 ' HD2' ' HA ' ' A' ' 8' ' ' CYS . 55.6 Cg_endo -73.69 98.23 1.04 Allowed 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 122.176 1.917 . . . . 0.0 110.261 153.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.54 ' HB3' ' HG2' ' A' ' 14' ' ' GLN . 1.9 m-20 -102.42 100.96 11.14 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 114.068 -1.424 . . . . 0.0 111.861 171.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 p -125.64 -89.71 0.56 Allowed 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 113.576 -1.647 . . . . 0.0 110.687 172.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -55.78 -40.92 73.3 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.563 1.145 . . . . 0.0 111.696 158.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.1 p -73.63 34.1 0.08 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 128.636 2.774 . . . . 0.0 115.102 171.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.54 ' HG2' ' HB3' ' A' ' 10' ' ' ASP . 4.8 mt-30 -77.49 70.32 3.86 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 123.793 1.758 . . . . 0.0 113.019 169.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -65.49 -43.98 88.49 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 110.912 -2.858 . . . . 0.0 109.135 162.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 67.1 m -124.47 151.15 44.94 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -178.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -103.3 -75.64 0.61 Allowed 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 111.609 -2.541 . . . . 0.0 109.537 174.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -96.86 52.5 1.18 Allowed 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 123.18 1.467 . . . . 0.0 109.89 177.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.59 105.29 0.53 Allowed Glycine 0 CA--C 1.525 0.678 0 CA-C-N 112.224 -2.262 . . . . 0.0 110.515 -175.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.2 p -71.01 91.59 0.89 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 171.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 p -95.83 143.43 27.06 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 112.077 -2.329 . . . . 0.0 117.061 -166.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.528 ' HB3' ' HB2' ' A' ' 5' ' ' PHE . 0.0 OUTLIER -101.16 105.46 16.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 111.493 -2.594 . . . . 0.0 110.101 177.528 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.49 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 37.8 t80 -80.39 96.85 6.82 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 112.992 -1.913 . . . . 0.0 110.872 -174.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.7 mt -69.93 93.42 0.77 Allowed 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 112.804 -1.998 . . . . 0.0 110.752 172.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 4' ' ' HIS . 57.5 t -48.55 -52.0 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 126.105 1.762 . . . . 0.0 111.458 -169.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.9 mp0 -60.07 -17.87 42.62 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 -176.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -113.0 -11.37 13.39 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.784 1.634 . . . . 0.0 114.536 177.177 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.464 ' O ' ' HD3' ' A' ' 30' ' ' PRO . 3.1 t70 54.62 30.23 12.88 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 127.976 2.51 . . . . 0.0 114.269 -164.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -97.32 111.91 59.55 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 113.737 -1.574 . . . . 0.0 112.805 -167.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' A' ' 28' ' ' ASP . 17.4 Cg_exo -79.58 95.41 1.04 Allowed 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.081 2.521 . . . . 0.0 109.429 170.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -97.18 128.72 44.33 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-O 121.949 0.881 . . . . 0.0 110.921 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.8 m -110.97 136.6 49.73 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -149.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 61.9 t -92.79 103.43 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 160.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 96.6 m -59.84 131.5 51.07 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.555 170.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.5 ' HB2' ' HD1' ' A' ' 38' ' ' TYR . 22.3 m170 -56.11 137.13 52.0 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.691 0.619 . . . . 0.0 109.591 174.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 t -59.42 103.4 0.19 Allowed 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 121.519 0.676 . . . . 0.0 110.862 175.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.99 -13.32 5.52 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 114.183 -1.371 . . . . 0.0 115.971 -162.113 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.5 ' HD1' ' HB2' ' A' ' 35' ' ' HIS . 86.6 m-85 -129.64 151.29 50.41 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.07 0.948 . . . . 0.0 113.026 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.754 HG22 ' HB2' ' A' ' 47' ' ' ASP . 3.1 m -122.72 166.0 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 113.79 -1.55 . . . . 0.0 112.407 164.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 124.54 151.44 8.1 Favored Glycine 0 N--CA 1.475 1.288 0 CA-C-N 113.674 -1.603 . . . . 0.0 111.164 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.04 73.56 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 117.458 0.629 . . . . 0.0 111.596 172.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.34 -4.86 59.06 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.359 1.464 . . . . 0.0 112.683 174.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 68.7 m 44.33 81.63 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.113 1.765 . . . . 0.0 114.298 -173.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -142.08 -31.84 0.53 Allowed 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 112.674 -2.057 . . . . 0.0 116.329 -178.016 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.431 ' HB2' HG23 ' A' ' 39' ' ' VAL . 55.6 m-70 -83.58 104.49 13.75 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 -169.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.67 108.98 1.54 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -172.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.754 ' HB2' HG22 ' A' ' 39' ' ' VAL . 20.0 t0 . . . . . 0 CA--C 1.547 0.838 0 CA-C-N 111.894 -2.412 . . . . 0.0 105.165 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -134.81 57.65 1.8 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.287 1.435 . . . . 0.0 110.83 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -77.61 131.45 37.8 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 114.652 -1.158 . . . . 0.0 113.288 -165.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -49.64 106.83 0.12 Allowed 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.708 173.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 23.6 m -48.27 121.59 9.34 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.524 1.529 . . . . 0.0 114.733 -165.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -78.49 82.31 2.51 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 N-CA-C 107.262 -1.861 . . . . 0.0 107.262 157.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -60.7 106.22 0.54 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -164.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 m -168.0 101.75 0.46 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 127.471 2.309 . . . . 0.0 109.009 165.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 70.66 -39.36 0.44 Allowed 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 126.191 1.796 . . . . 0.0 112.871 -161.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.9 p -62.16 55.48 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 127.131 2.172 . . . . 0.0 112.49 157.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -125.13 -71.71 0.7 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.798 1.639 . . . . 0.0 112.698 -174.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.551 ' HB3' ' HB2' ' A' ' 30' ' ' PRO . 7.6 t80 51.61 -25.79 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 118.27 2.692 . . . . 0.0 118.27 -177.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.8 m -117.3 165.5 13.39 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.538 1.135 . . . . 0.0 113.985 170.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -86.82 -78.43 0.29 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 113.392 -1.731 . . . . 0.0 110.073 171.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -100.13 57.38 0.96 Allowed 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 122.937 1.351 . . . . 0.0 108.91 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -149.49 98.66 0.19 Allowed Glycine 0 CA--C 1.526 0.74 0 CA-C-N 112.235 -2.257 . . . . 0.0 111.519 -174.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.4 p -71.4 94.6 1.26 Allowed 'General case' 0 C--N 1.317 -0.846 0 O-C-N 125.411 1.3 . . . . 0.0 110.15 -177.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 32' ' ' CYS . 30.4 p -74.5 149.65 40.19 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 -169.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -112.09 122.02 46.58 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 112.486 -2.143 . . . . 0.0 109.035 166.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -84.4 105.16 15.02 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 113.073 -1.876 . . . . 0.0 111.71 -174.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.7 91.45 2.91 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 112.942 -1.936 . . . . 0.0 109.996 175.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.3 t -52.52 -60.12 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 125.17 1.388 . . . . 0.0 111.171 -169.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.496 ' H ' ' CD ' ' A' ' 26' ' ' GLN . 4.3 pm0 -55.34 -14.68 1.97 Allowed 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 116.999 2.222 . . . . 0.0 116.999 177.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -113.38 -7.66 13.47 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 125.049 1.34 . . . . 0.0 114.199 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.6 p30 52.21 29.25 6.35 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 127.647 2.379 . . . . 0.0 115.244 -170.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -119.03 122.6 29.5 Favored Pre-proline 0 N--CA 1.476 0.852 0 CA-C-N 113.51 -1.677 . . . . 0.0 112.361 -166.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.551 ' HB2' ' HB3' ' A' ' 15' ' ' PHE . 31.2 Cg_exo -74.65 133.4 17.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.066 1.844 . . . . 0.0 109.894 160.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -133.98 140.84 47.0 Favored 'General case' 0 N--CA 1.483 1.179 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.513 168.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 21' ' ' CYS . 60.1 m -108.67 137.75 46.1 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -152.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.2 t -81.73 92.88 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 CA-C-N 113.381 -1.736 . . . . 0.0 106.773 158.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 79.1 m -55.43 129.26 38.01 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.441 171.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 26.5 m170 -55.64 155.91 5.26 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.644 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.9 m -40.09 105.82 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 125.342 1.457 . . . . 0.0 114.264 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.15 10.44 83.79 Favored Glycine 0 CA--C 1.541 1.713 0 CA-C-N 113.757 -1.565 . . . . 0.0 116.298 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -90.26 134.54 34.24 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 122.713 1.244 . . . . 0.0 113.163 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.0 m -110.74 159.78 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-N 113.013 -1.903 . . . . 0.0 112.141 169.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.2 151.52 8.76 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 113.265 -1.789 . . . . 0.0 111.529 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.57 -33.63 76.03 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 115.067 -0.566 . . . . 0.0 111.87 175.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.63 6.86 44.14 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.205 1.402 . . . . 0.0 111.873 177.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 60.6 m 38.05 75.28 0.07 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.727 2.011 . . . . 0.0 113.056 -170.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -120.92 -35.07 3.41 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 113.487 -1.688 . . . . 0.0 115.197 -171.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -105.95 103.13 12.56 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 -163.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.71 114.67 6.51 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.45 1.119 . . . . 0.0 111.37 175.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.2 t0 . . . . . 0 N--CA 1.473 0.722 0 CA-C-N 112.723 -2.035 . . . . 0.0 110.884 -165.797 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.4 t60 . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 121.236 0.541 . . . . 0.0 112.442 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.613 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . 52.2 p90 -114.25 -28.17 7.36 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 116.618 2.081 . . . . 0.0 116.618 -171.551 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 p30 38.79 -104.39 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -173.45 136.84 0.62 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.734 2.014 . . . . 0.0 110.536 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.596 ' HB2' ' HB2' ' A' ' 12' ' ' HIS . 26.7 p -73.64 137.45 77.27 Favored Pre-proline 0 N--CA 1.485 1.292 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 177.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -76.36 -179.61 5.45 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.408 2.739 . . . . 0.0 113.701 165.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -51.74 -41.4 61.52 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 -175.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 p -51.64 -33.43 33.39 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.764 1.269 . . . . 0.0 113.979 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.596 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 15.8 m-70 -106.85 -24.46 12.05 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.055 -1.429 . . . . 0.0 114.018 -168.161 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.3 p -63.98 -29.05 70.24 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 155.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -85.41 -12.46 51.98 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 117.465 2.395 . . . . 0.0 117.465 172.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -68.54 -62.02 1.57 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.255 146.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.462 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 80.5 m -91.86 80.33 5.24 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.043 0.925 . . . . 0.0 112.218 -176.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -56.91 -52.04 66.73 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 114.162 -1.381 . . . . 0.0 113.348 -169.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -117.54 49.04 1.26 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 123.142 1.449 . . . . 0.0 110.029 167.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.413 ' HA3' ' HB3' ' A' ' 16' ' ' CYS . . . -130.97 115.22 1.72 Allowed Glycine 0 N--CA 1.479 1.51 0 CA-C-N 112.632 -2.076 . . . . 0.0 110.279 178.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.6 p -74.62 80.28 2.0 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 113.943 -1.129 . . . . 0.0 109.776 170.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.462 ' HB3' ' SG ' ' A' ' 16' ' ' CYS . 1.3 p -77.56 147.66 35.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 112.237 -2.256 . . . . 0.0 116.958 -166.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.613 ' HB3' ' HB2' ' A' ' 5' ' ' PHE . 99.4 mtt180 -118.13 123.06 44.65 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 111.996 -2.366 . . . . 0.0 110.325 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -84.07 85.54 7.33 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 123.472 1.606 . . . . 0.0 109.304 178.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.431 ' HB3' HE22 ' A' ' 26' ' ' GLN . 15.5 mt -71.41 89.41 0.92 Allowed 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 112.151 -2.295 . . . . 0.0 111.957 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 14.1 t -58.06 -44.71 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 CA-C-N 112.842 -1.981 . . . . 0.0 111.581 -161.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.431 HE22 ' HB3' ' A' ' 24' ' ' LEU . 4.0 pm0 -56.89 -22.2 35.4 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.968 2.21 . . . . 0.0 116.968 178.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -115.33 1.32 13.72 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.4 p30 49.57 29.44 3.0 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.418 2.687 . . . . 0.0 115.353 -166.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -97.04 109.08 47.53 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 113.318 -1.764 . . . . 0.0 112.947 -165.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.478 ' HB2' ' HB3' ' A' ' 12' ' ' HIS . 58.4 Cg_endo -83.9 48.78 2.65 Favored 'Trans proline' 0 N--CA 1.488 1.185 0 C-N-CA 122.714 2.276 . . . . 0.0 113.725 -177.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.81 148.85 32.74 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -165.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.0 m -82.87 143.32 30.84 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.254 -1.339 . . . . 0.0 113.083 -165.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.4 t -100.74 102.07 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 152.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.523 ' SG ' ' HA2' ' A' ' 40' ' ' GLY . 98.9 m -57.58 134.7 56.37 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 120.96 0.41 . . . . 0.0 111.888 177.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -56.51 164.22 1.49 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 114.406 -1.27 . . . . 0.0 111.758 174.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.6 p -51.09 107.77 0.2 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.075 1.35 . . . . 0.0 113.414 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.4 20.49 62.16 Favored Glycine 0 CA--C 1.543 1.804 0 CA-C-N 113.988 -1.46 . . . . 0.0 115.569 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -107.49 153.09 23.33 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 174.038 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.516 HG23 ' HB2' ' A' ' 45' ' ' HIS . 3.9 m -119.56 165.21 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 177.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.523 ' HA2' ' SG ' ' A' ' 34' ' ' CYS . . . -104.77 -148.2 17.7 Favored Glycine 0 N--CA 1.476 1.333 0 N-CA-C 119.234 2.454 . . . . 0.0 119.234 -129.254 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.44 ' HB3' HH11 ' A' ' 42' ' ' ARG . . . 61.73 -67.72 0.06 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 111.604 -2.298 . . . . 0.0 113.683 -160.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.44 HH11 ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -110.87 -3.62 15.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.861 1.664 . . . . 0.0 114.922 174.63 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 39' ' ' VAL . 33.5 m 45.61 68.08 0.64 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 126.136 1.775 . . . . 0.0 111.471 -176.213 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -120.65 22.38 11.21 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-O 122.568 1.175 . . . . 0.0 111.072 172.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.516 ' HB2' HG23 ' A' ' 39' ' ' VAL . 16.4 m-70 -140.51 144.59 36.07 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 -165.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.0 142.87 34.97 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.6 0.563 . . . . 0.0 111.322 174.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 t70 . . . . . 0 N--CA 1.48 1.038 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.761 -177.734 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 CA--C 1.548 0.873 0 CA-C-O 122.225 1.012 . . . . 0.0 113.149 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 49.7 t 61.08 109.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 CA-C-N 113.027 -1.897 . . . . 0.0 110.826 177.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.0 p -42.21 -56.66 2.82 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 -162.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -49.24 -39.38 30.04 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.964 1.306 . . . . 0.0 114.375 176.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -87.01 -69.1 0.7 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.871 1.268 . . . . 0.0 110.149 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.414 ' HA ' HG23 ' A' ' 25' ' ' VAL . 46.2 t30 -137.73 154.05 49.67 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 116.019 1.859 . . . . 0.0 116.019 176.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -166.02 95.47 0.59 Allowed 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 110.329 -3.123 . . . . 0.0 109.17 158.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 33.0 t -113.78 140.56 24.84 Favored Pre-proline 0 CA--C 1.55 0.972 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -173.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -57.91 172.25 1.26 Allowed 'Trans proline' 0 N--CA 1.481 0.778 0 C-N-CA 124.325 3.35 . . . . 0.0 112.246 160.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -125.33 -47.16 1.75 Allowed 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 116.351 1.982 . . . . 0.0 116.351 175.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 56.8 p -67.63 93.49 0.37 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.137 0.975 . . . . 0.0 110.879 167.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 2.4 t60 52.21 99.02 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 124.004 1.859 . . . . 0.0 111.398 -149.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.472 HG22 ' O ' ' A' ' 16' ' ' CYS . 3.0 t -83.68 47.1 1.23 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 112.06 -2.336 . . . . 0.0 111.817 -176.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 64.89 -46.82 0.34 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.872 2.069 . . . . 0.0 116.375 -172.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -90.76 -52.22 4.98 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.093 1.357 . . . . 0.0 112.797 172.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.472 ' O ' HG22 ' A' ' 13' ' ' THR . 38.6 m -117.7 148.54 41.89 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -166.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -63.37 -59.6 4.48 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 114.807 -1.088 . . . . 0.0 113.651 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -115.26 63.45 0.68 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 123.362 1.553 . . . . 0.0 111.242 175.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.63 164.77 16.64 Favored Glycine 0 N--CA 1.476 1.302 0 CA-C-N 111.789 -2.459 . . . . 0.0 111.058 175.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.9 p -125.26 95.48 4.49 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 112.815 -1.693 . . . . 0.0 109.47 169.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.48 ' SG ' ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -87.94 141.52 28.51 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.754 2.131 . . . . 0.0 116.754 -163.003 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -85.94 81.28 8.58 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 112.13 -2.305 . . . . 0.0 107.261 157.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.48 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 26.5 t80 -69.52 89.91 0.53 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 112.587 -2.097 . . . . 0.0 107.945 163.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 76.2 mt -64.2 88.55 0.05 Allowed 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 112.753 -2.021 . . . . 0.0 108.753 172.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.414 HG23 ' HA ' ' A' ' 6' ' ' ASN . 84.0 t -55.71 -48.97 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-N 112.304 -2.225 . . . . 0.0 110.95 -166.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -26.61 66.31 Favored 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -92.84 -15.54 26.36 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 126.786 2.034 . . . . 0.0 115.186 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 p30 55.55 34.26 22.77 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.947 2.499 . . . . 0.0 115.876 -167.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -118.37 109.98 39.79 Favored Pre-proline 0 N--CA 1.486 1.357 0 CA-C-N 114.022 -1.445 . . . . 0.0 113.135 -172.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 96.5 Cg_endo -88.22 128.48 2.24 Favored 'Trans proline' 0 N--CA 1.481 0.735 0 C-N-CA 121.151 1.234 . . . . 0.0 113.774 170.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -139.7 145.54 38.49 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 114.776 -1.102 . . . . 0.0 113.532 168.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.0 m -112.5 143.38 43.75 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -148.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.3 t -94.32 101.89 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-N 113.334 -1.757 . . . . 0.0 106.977 155.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.4 m -57.26 140.14 50.72 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 177.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -56.47 160.55 3.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 121.806 0.813 . . . . 0.0 112.566 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.9 p -53.02 107.81 0.26 Allowed 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 114.272 -1.331 . . . . 0.0 112.779 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.14 26.41 52.66 Favored Glycine 0 N--CA 1.484 1.835 0 CA-C-N 114.108 -1.406 . . . . 0.0 115.318 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -117.77 153.07 34.05 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.814 0.846 . . . . 0.0 113.178 172.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.646 HG23 ' HB2' ' A' ' 45' ' ' HIS . 8.5 m -121.2 165.98 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -111.03 -142.08 8.92 Favored Glycine 0 CA--C 1.535 1.313 0 N-CA-C 119.001 2.36 . . . . 0.0 119.001 -129.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.16 -75.09 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 126.595 1.958 . . . . 0.0 112.109 -154.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.8 ttt180 -113.32 30.23 7.37 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.974 176.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 16' ' ' CYS . 34.5 m 23.48 62.93 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 128.492 2.717 . . . . 0.0 113.527 -175.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -93.11 -26.48 17.43 Favored 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 113.471 -1.695 . . . . 0.0 112.473 -176.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.646 ' HB2' HG23 ' A' ' 39' ' ' VAL . 43.4 m-70 -115.2 146.9 40.96 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -156.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.466 ' HB3' ' O ' ' A' ' 49' ' ' LEU . . . -78.58 151.82 32.19 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.517 0.675 . . . . 0.0 111.946 164.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -59.11 100.31 0.07 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.065 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 31.1 tp 82.13 -44.87 0.16 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 112.156 -2.293 . . . . 0.0 112.359 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.466 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 6.0 mp -83.11 54.47 2.78 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.125 1.77 . . . . 0.0 110.088 173.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.333 0 CA-C-O 115.998 -1.953 . . . . 0.0 116.202 -171.873 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 115.598 1.703 . . . . 0.0 115.598 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 43.4 t -65.08 100.12 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.186 1.394 . . . . 0.0 109.388 -174.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.5 p -152.69 -76.12 0.13 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -170.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.405 ' O ' HG23 ' A' ' 25' ' ' VAL . 63.3 m80 -87.89 92.56 9.17 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.267 0.556 . . . . 0.0 111.394 -167.271 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.528 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . 44.9 p90 -95.69 121.9 37.88 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 114.288 -1.324 . . . . 0.0 113.031 175.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -114.36 174.76 5.79 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 113.996 -1.457 . . . . 0.0 113.336 172.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -69.84 103.11 2.11 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 121.159 0.504 . . . . 0.0 111.788 173.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 23' ' ' PHE . 26.5 p -48.32 120.01 8.1 Favored Pre-proline 0 N--CA 1.481 1.099 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -164.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.488 ' HD2' ' HA ' ' A' ' 8' ' ' CYS . 55.6 Cg_endo -73.69 98.23 1.04 Allowed 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 122.176 1.917 . . . . 0.0 110.261 153.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.54 ' HB3' ' HG2' ' A' ' 14' ' ' GLN . 1.9 m-20 -102.42 100.96 11.14 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 114.068 -1.424 . . . . 0.0 111.861 171.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 p -125.64 -89.71 0.56 Allowed 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 113.576 -1.647 . . . . 0.0 110.687 172.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -55.78 -40.92 73.3 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.563 1.145 . . . . 0.0 111.696 158.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.1 p -73.63 34.1 0.08 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 128.636 2.774 . . . . 0.0 115.102 171.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.54 ' HG2' ' HB3' ' A' ' 10' ' ' ASP . 4.8 mt-30 -77.49 70.32 3.86 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 123.793 1.758 . . . . 0.0 113.019 169.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -65.49 -43.98 88.49 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 110.912 -2.858 . . . . 0.0 109.135 162.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 67.1 m -124.47 151.15 44.94 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -178.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -103.3 -75.64 0.61 Allowed 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 111.609 -2.541 . . . . 0.0 109.537 174.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -96.86 52.5 1.18 Allowed 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 123.18 1.467 . . . . 0.0 109.89 177.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.59 105.29 0.53 Allowed Glycine 0 CA--C 1.525 0.678 0 CA-C-N 112.224 -2.262 . . . . 0.0 110.515 -175.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.2 p -71.01 91.59 0.89 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 171.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 p -95.83 143.43 27.06 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 112.077 -2.329 . . . . 0.0 117.061 -166.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.528 ' HB3' ' HB2' ' A' ' 5' ' ' PHE . 0.0 OUTLIER -101.16 105.46 16.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 111.493 -2.594 . . . . 0.0 110.101 177.528 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.49 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 37.8 t80 -80.39 96.85 6.82 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 112.992 -1.913 . . . . 0.0 110.872 -174.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.7 mt -69.93 93.42 0.77 Allowed 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 112.804 -1.998 . . . . 0.0 110.752 172.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 4' ' ' HIS . 57.5 t -48.55 -52.0 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 126.105 1.762 . . . . 0.0 111.458 -169.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.9 mp0 -60.07 -17.87 42.62 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 -176.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -113.0 -11.37 13.39 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.784 1.634 . . . . 0.0 114.536 177.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.464 ' O ' ' HD3' ' A' ' 30' ' ' PRO . 3.1 t70 54.62 30.23 12.88 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 127.976 2.51 . . . . 0.0 114.269 -164.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -97.32 111.91 59.55 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 113.737 -1.574 . . . . 0.0 112.805 -167.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' A' ' 28' ' ' ASP . 17.4 Cg_exo -79.58 95.41 1.04 Allowed 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.081 2.521 . . . . 0.0 109.429 170.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -97.18 128.72 44.33 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-O 121.949 0.881 . . . . 0.0 110.921 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.8 m -110.97 136.6 49.73 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -149.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 61.9 t -92.79 103.43 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 160.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 96.6 m -59.84 131.5 51.07 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.555 170.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.5 ' HB2' ' HD1' ' A' ' 38' ' ' TYR . 22.3 m170 -56.11 137.13 52.0 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.691 0.619 . . . . 0.0 109.591 174.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 t -59.42 103.4 0.19 Allowed 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 121.519 0.676 . . . . 0.0 110.862 175.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.99 -13.32 5.52 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 114.183 -1.371 . . . . 0.0 115.971 -162.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.5 ' HD1' ' HB2' ' A' ' 35' ' ' HIS . 86.6 m-85 -129.64 151.29 50.41 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.07 0.948 . . . . 0.0 113.026 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.754 HG22 ' HB2' ' A' ' 47' ' ' ASP . 3.1 m -122.72 166.0 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 113.79 -1.55 . . . . 0.0 112.407 164.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 124.54 151.44 8.1 Favored Glycine 0 N--CA 1.475 1.288 0 CA-C-N 113.674 -1.603 . . . . 0.0 111.164 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.04 73.56 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 117.458 0.629 . . . . 0.0 111.596 172.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.34 -4.86 59.06 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.359 1.464 . . . . 0.0 112.683 174.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 68.7 m 44.33 81.63 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.113 1.765 . . . . 0.0 114.298 -173.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -142.08 -31.84 0.53 Allowed 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 112.674 -2.057 . . . . 0.0 116.329 -178.016 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.431 ' HB2' HG23 ' A' ' 39' ' ' VAL . 55.6 m-70 -83.58 104.49 13.75 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 -169.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.67 108.98 1.54 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -172.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.754 ' HB2' HG22 ' A' ' 39' ' ' VAL . 20.0 t0 -108.48 87.13 2.42 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 111.894 -2.412 . . . . 0.0 105.165 177.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 61.2 mt -74.41 64.18 1.12 Allowed 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 118.249 2.685 . . . . 0.0 118.249 -152.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -85.82 46.0 1.27 Allowed 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 112.984 -1.916 . . . . 0.0 110.809 166.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-N 113.737 -1.574 . . . . 0.0 114.837 -174.066 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.484 1.246 0 CA-C-O 122.635 1.207 . . . . 0.0 113.23 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.1 t -49.22 -45.21 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 CA-C-N 113.271 -1.786 . . . . 0.0 113.249 -168.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.2 t -48.63 -41.28 30.6 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -66.08 -23.81 66.59 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -134.81 57.65 1.8 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.287 1.435 . . . . 0.0 110.83 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -77.61 131.45 37.8 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 114.652 -1.158 . . . . 0.0 113.288 -165.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -49.64 106.83 0.12 Allowed 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.708 173.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 23.6 m -48.27 121.59 9.34 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.524 1.529 . . . . 0.0 114.733 -165.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -78.49 82.31 2.51 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 N-CA-C 107.262 -1.861 . . . . 0.0 107.262 157.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -60.7 106.22 0.54 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -164.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 m -168.0 101.75 0.46 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 127.471 2.309 . . . . 0.0 109.009 165.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 70.66 -39.36 0.44 Allowed 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 126.191 1.796 . . . . 0.0 112.871 -161.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.9 p -62.16 55.48 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 127.131 2.172 . . . . 0.0 112.49 157.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -125.13 -71.71 0.7 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.798 1.639 . . . . 0.0 112.698 -174.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.551 ' HB3' ' HB2' ' A' ' 30' ' ' PRO . 7.6 t80 51.61 -25.79 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 118.27 2.692 . . . . 0.0 118.27 -177.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.8 m -117.3 165.5 13.39 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.538 1.135 . . . . 0.0 113.985 170.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -86.82 -78.43 0.29 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 113.392 -1.731 . . . . 0.0 110.073 171.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -100.13 57.38 0.96 Allowed 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 122.937 1.351 . . . . 0.0 108.91 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -149.49 98.66 0.19 Allowed Glycine 0 CA--C 1.526 0.74 0 CA-C-N 112.235 -2.257 . . . . 0.0 111.519 -174.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.4 p -71.4 94.6 1.26 Allowed 'General case' 0 C--N 1.317 -0.846 0 O-C-N 125.411 1.3 . . . . 0.0 110.15 -177.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 32' ' ' CYS . 30.4 p -74.5 149.65 40.19 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 -169.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -112.09 122.02 46.58 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 112.486 -2.143 . . . . 0.0 109.035 166.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -84.4 105.16 15.02 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 113.073 -1.876 . . . . 0.0 111.71 -174.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.7 91.45 2.91 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 112.942 -1.936 . . . . 0.0 109.996 175.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.3 t -52.52 -60.12 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 125.17 1.388 . . . . 0.0 111.171 -169.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.496 ' H ' ' CD ' ' A' ' 26' ' ' GLN . 4.3 pm0 -55.34 -14.68 1.97 Allowed 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 116.999 2.222 . . . . 0.0 116.999 177.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -113.38 -7.66 13.47 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 125.049 1.34 . . . . 0.0 114.199 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.6 p30 52.21 29.25 6.35 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 127.647 2.379 . . . . 0.0 115.244 -170.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -119.03 122.6 29.5 Favored Pre-proline 0 N--CA 1.476 0.852 0 CA-C-N 113.51 -1.677 . . . . 0.0 112.361 -166.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.551 ' HB2' ' HB3' ' A' ' 15' ' ' PHE . 31.2 Cg_exo -74.65 133.4 17.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.066 1.844 . . . . 0.0 109.894 160.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -133.98 140.84 47.0 Favored 'General case' 0 N--CA 1.483 1.179 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.513 168.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 21' ' ' CYS . 60.1 m -108.67 137.75 46.1 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -152.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.2 t -81.73 92.88 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 CA-C-N 113.381 -1.736 . . . . 0.0 106.773 158.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 79.1 m -55.43 129.26 38.01 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.441 171.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 26.5 m170 -55.64 155.91 5.26 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.644 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.9 m -40.09 105.82 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 125.342 1.457 . . . . 0.0 114.264 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.15 10.44 83.79 Favored Glycine 0 CA--C 1.541 1.713 0 CA-C-N 113.757 -1.565 . . . . 0.0 116.298 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -90.26 134.54 34.24 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 122.713 1.244 . . . . 0.0 113.163 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.0 m -110.74 159.78 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-N 113.013 -1.903 . . . . 0.0 112.141 169.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.2 151.52 8.76 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 113.265 -1.789 . . . . 0.0 111.529 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.57 -33.63 76.03 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 115.067 -0.566 . . . . 0.0 111.87 175.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.63 6.86 44.14 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.205 1.402 . . . . 0.0 111.873 177.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 60.6 m 38.05 75.28 0.07 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.727 2.011 . . . . 0.0 113.056 -170.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -120.92 -35.07 3.41 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 113.487 -1.688 . . . . 0.0 115.197 -171.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -105.95 103.13 12.56 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 -163.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.71 114.67 6.51 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.45 1.119 . . . . 0.0 111.37 175.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -77.36 96.63 4.68 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 112.723 -2.035 . . . . 0.0 110.884 -165.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.6 mt -47.32 -37.03 10.17 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 170.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.6 mt -91.94 66.79 5.1 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 123.151 1.453 . . . . 0.0 108.256 171.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.39 0 CA-C-N 112.314 -2.221 . . . . 0.0 114.867 178.632 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 122.868 1.318 . . . . 0.0 114.079 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.8 t -78.72 97.93 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.823 -174.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.0 p -66.07 85.76 0.09 Allowed 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 114.41 -1.268 . . . . 0.0 112.837 174.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -162.52 155.07 19.3 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 114.166 -1.379 . . . . 0.0 112.442 -178.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.613 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . 52.2 p90 -114.25 -28.17 7.36 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 116.618 2.081 . . . . 0.0 116.618 -171.551 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 p30 38.79 -104.39 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -173.45 136.84 0.62 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.734 2.014 . . . . 0.0 110.536 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.596 ' HB2' ' HB2' ' A' ' 12' ' ' HIS . 26.7 p -73.64 137.45 77.27 Favored Pre-proline 0 N--CA 1.485 1.292 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 177.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -76.36 -179.61 5.45 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.408 2.739 . . . . 0.0 113.701 165.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -51.74 -41.4 61.52 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 -175.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 p -51.64 -33.43 33.39 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.764 1.269 . . . . 0.0 113.979 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.596 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 15.8 m-70 -106.85 -24.46 12.05 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.055 -1.429 . . . . 0.0 114.018 -168.161 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.3 p -63.98 -29.05 70.24 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 155.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -85.41 -12.46 51.98 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 117.465 2.395 . . . . 0.0 117.465 172.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -68.54 -62.02 1.57 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.255 146.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.462 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 80.5 m -91.86 80.33 5.24 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.043 0.925 . . . . 0.0 112.218 -176.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -56.91 -52.04 66.73 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 114.162 -1.381 . . . . 0.0 113.348 -169.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -117.54 49.04 1.26 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 123.142 1.449 . . . . 0.0 110.029 167.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.413 ' HA3' ' HB3' ' A' ' 16' ' ' CYS . . . -130.97 115.22 1.72 Allowed Glycine 0 N--CA 1.479 1.51 0 CA-C-N 112.632 -2.076 . . . . 0.0 110.279 178.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.6 p -74.62 80.28 2.0 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 113.943 -1.129 . . . . 0.0 109.776 170.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.462 ' HB3' ' SG ' ' A' ' 16' ' ' CYS . 1.3 p -77.56 147.66 35.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 112.237 -2.256 . . . . 0.0 116.958 -166.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.613 ' HB3' ' HB2' ' A' ' 5' ' ' PHE . 99.4 mtt180 -118.13 123.06 44.65 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 111.996 -2.366 . . . . 0.0 110.325 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -84.07 85.54 7.33 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 123.472 1.606 . . . . 0.0 109.304 178.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.431 ' HB3' HE22 ' A' ' 26' ' ' GLN . 15.5 mt -71.41 89.41 0.92 Allowed 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 112.151 -2.295 . . . . 0.0 111.957 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 14.1 t -58.06 -44.71 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 CA-C-N 112.842 -1.981 . . . . 0.0 111.581 -161.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.431 HE22 ' HB3' ' A' ' 24' ' ' LEU . 4.0 pm0 -56.89 -22.2 35.4 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.968 2.21 . . . . 0.0 116.968 178.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -115.33 1.32 13.72 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.4 p30 49.57 29.44 3.0 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.418 2.687 . . . . 0.0 115.353 -166.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -97.04 109.08 47.53 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 113.318 -1.764 . . . . 0.0 112.947 -165.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.478 ' HB2' ' HB3' ' A' ' 12' ' ' HIS . 58.4 Cg_endo -83.9 48.78 2.65 Favored 'Trans proline' 0 N--CA 1.488 1.185 0 C-N-CA 122.714 2.276 . . . . 0.0 113.725 -177.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.81 148.85 32.74 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -165.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.0 m -82.87 143.32 30.84 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.254 -1.339 . . . . 0.0 113.083 -165.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.4 t -100.74 102.07 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 152.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.523 ' SG ' ' HA2' ' A' ' 40' ' ' GLY . 98.9 m -57.58 134.7 56.37 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 120.96 0.41 . . . . 0.0 111.888 177.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -56.51 164.22 1.49 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 114.406 -1.27 . . . . 0.0 111.758 174.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.6 p -51.09 107.77 0.2 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.075 1.35 . . . . 0.0 113.414 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.4 20.49 62.16 Favored Glycine 0 CA--C 1.543 1.804 0 CA-C-N 113.988 -1.46 . . . . 0.0 115.569 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -107.49 153.09 23.33 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 174.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.516 HG23 ' HB2' ' A' ' 45' ' ' HIS . 3.9 m -119.56 165.21 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 177.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.523 ' HA2' ' SG ' ' A' ' 34' ' ' CYS . . . -104.77 -148.2 17.7 Favored Glycine 0 N--CA 1.476 1.333 0 N-CA-C 119.234 2.454 . . . . 0.0 119.234 -129.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.44 ' HB3' HH11 ' A' ' 42' ' ' ARG . . . 61.73 -67.72 0.06 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 111.604 -2.298 . . . . 0.0 113.683 -160.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.44 HH11 ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -110.87 -3.62 15.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.861 1.664 . . . . 0.0 114.922 174.63 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 39' ' ' VAL . 33.5 m 45.61 68.08 0.64 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 126.136 1.775 . . . . 0.0 111.471 -176.213 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -120.65 22.38 11.21 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-O 122.568 1.175 . . . . 0.0 111.072 172.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.516 ' HB2' HG23 ' A' ' 39' ' ' VAL . 16.4 m-70 -140.51 144.59 36.07 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 -165.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.0 142.87 34.97 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.6 0.563 . . . . 0.0 111.322 174.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -73.91 83.98 1.71 Allowed 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.761 -177.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.8 mt -73.56 76.46 1.47 Allowed 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 113.655 -1.611 . . . . 0.0 111.404 173.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -170.77 -60.05 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 111.842 -2.436 . . . . 0.0 107.66 -172.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.09 0 CA-C-O 117.127 -1.416 . . . . 0.0 113.321 166.297 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 8.9 t60 . . . . . 0 CA--C 1.552 1.025 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -87.01 -69.1 0.7 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.871 1.268 . . . . 0.0 110.149 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.679 HD21 ' HB2' ' A' ' 8' ' ' CYS . 25.8 t-20 -137.73 154.05 49.67 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 116.019 1.859 . . . . 0.0 116.019 176.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -166.02 95.47 0.59 Allowed 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 110.329 -3.123 . . . . 0.0 109.17 158.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.679 ' HB2' HD21 ' A' ' 6' ' ' ASN . 33.0 t -113.78 140.56 24.84 Favored Pre-proline 0 CA--C 1.55 0.972 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -173.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -57.91 172.25 1.26 Allowed 'Trans proline' 0 N--CA 1.481 0.778 0 C-N-CA 124.325 3.35 . . . . 0.0 112.246 160.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -125.33 -47.16 1.75 Allowed 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 116.351 1.982 . . . . 0.0 116.351 175.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 56.8 p -67.63 93.49 0.37 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.137 0.975 . . . . 0.0 110.879 167.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 2.4 t60 52.21 99.02 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 124.004 1.859 . . . . 0.0 111.398 -149.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.472 HG22 ' O ' ' A' ' 16' ' ' CYS . 3.0 t -83.68 47.1 1.23 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 112.06 -2.336 . . . . 0.0 111.817 -176.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 64.89 -46.82 0.34 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.872 2.069 . . . . 0.0 116.375 -172.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -90.76 -52.22 4.98 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.093 1.357 . . . . 0.0 112.797 172.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.472 ' O ' HG22 ' A' ' 13' ' ' THR . 38.6 m -117.7 148.54 41.89 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -166.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -63.37 -59.6 4.48 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 114.807 -1.088 . . . . 0.0 113.651 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -115.26 63.45 0.68 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 123.362 1.553 . . . . 0.0 111.242 175.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.63 164.77 16.64 Favored Glycine 0 N--CA 1.476 1.302 0 CA-C-N 111.789 -2.459 . . . . 0.0 111.058 175.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.9 p -125.26 95.48 4.49 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 112.815 -1.693 . . . . 0.0 109.47 169.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.48 ' SG ' ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -87.94 141.52 28.51 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.754 2.131 . . . . 0.0 116.754 -163.003 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -85.94 81.28 8.58 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 112.13 -2.305 . . . . 0.0 107.261 157.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.48 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 26.5 t80 -69.52 89.91 0.53 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 112.587 -2.097 . . . . 0.0 107.945 163.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 76.2 mt -64.2 88.55 0.05 Allowed 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 112.753 -2.021 . . . . 0.0 108.753 172.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.414 HG23 ' HA ' ' A' ' 6' ' ' ASN . 84.0 t -55.71 -48.97 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-N 112.304 -2.225 . . . . 0.0 110.95 -166.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -26.61 66.31 Favored 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -92.84 -15.54 26.36 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 126.786 2.034 . . . . 0.0 115.186 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 p30 55.55 34.26 22.77 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.947 2.499 . . . . 0.0 115.876 -167.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -118.37 109.98 39.79 Favored Pre-proline 0 N--CA 1.486 1.357 0 CA-C-N 114.022 -1.445 . . . . 0.0 113.135 -172.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 96.5 Cg_endo -88.22 128.48 2.24 Favored 'Trans proline' 0 N--CA 1.481 0.735 0 C-N-CA 121.151 1.234 . . . . 0.0 113.774 170.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -139.7 145.54 38.49 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 114.776 -1.102 . . . . 0.0 113.532 168.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.0 m -112.5 143.38 43.75 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -148.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.3 t -94.32 101.89 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-N 113.334 -1.757 . . . . 0.0 106.977 155.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.4 m -57.26 140.14 50.72 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 177.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -56.47 160.55 3.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 121.806 0.813 . . . . 0.0 112.566 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.9 p -53.02 107.81 0.26 Allowed 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 114.272 -1.331 . . . . 0.0 112.779 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.14 26.41 52.66 Favored Glycine 0 N--CA 1.484 1.835 0 CA-C-N 114.108 -1.406 . . . . 0.0 115.318 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -117.77 153.07 34.05 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.814 0.846 . . . . 0.0 113.178 172.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.646 HG23 ' HB2' ' A' ' 45' ' ' HIS . 8.5 m -121.2 165.98 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -111.03 -142.08 8.92 Favored Glycine 0 CA--C 1.535 1.313 0 N-CA-C 119.001 2.36 . . . . 0.0 119.001 -129.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.16 -75.09 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 126.595 1.958 . . . . 0.0 112.109 -154.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.8 ttt180 -113.32 30.23 7.37 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.974 176.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 16' ' ' CYS . 34.5 m 23.48 62.93 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 128.492 2.717 . . . . 0.0 113.527 -175.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -93.11 -26.48 17.43 Favored 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 113.471 -1.695 . . . . 0.0 112.473 -176.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.646 ' HB2' HG23 ' A' ' 39' ' ' VAL . 43.4 m-70 -115.2 146.9 40.96 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -156.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.58 151.82 32.19 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.517 0.675 . . . . 0.0 111.946 164.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.5 t70 . . . . . 0 N--CA 1.479 1.001 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.065 179.733 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.405 ' O ' HG23 ' A' ' 25' ' ' VAL . 63.3 m80 . . . . . 0 N--CA 1.471 0.604 0 CA-C-O 121.267 0.556 . . . . 0.0 111.394 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.528 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . 44.9 p90 -95.69 121.9 37.88 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 114.288 -1.324 . . . . 0.0 113.031 175.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -114.36 174.76 5.79 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 113.996 -1.457 . . . . 0.0 113.336 172.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -69.84 103.11 2.11 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 121.159 0.504 . . . . 0.0 111.788 173.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 23' ' ' PHE . 26.5 p -48.32 120.01 8.1 Favored Pre-proline 0 N--CA 1.481 1.099 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -164.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.488 ' HD2' ' HA ' ' A' ' 8' ' ' CYS . 55.6 Cg_endo -73.69 98.23 1.04 Allowed 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 122.176 1.917 . . . . 0.0 110.261 153.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.54 ' HB3' ' HG2' ' A' ' 14' ' ' GLN . 1.9 m-20 -102.42 100.96 11.14 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 114.068 -1.424 . . . . 0.0 111.861 171.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 p -125.64 -89.71 0.56 Allowed 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 113.576 -1.647 . . . . 0.0 110.687 172.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.458 ' HD2' HG23 ' A' ' 13' ' ' THR . 1.4 p-80 -55.78 -40.92 73.3 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.563 1.145 . . . . 0.0 111.696 158.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.458 HG23 ' HD2' ' A' ' 12' ' ' HIS . 4.1 p -73.63 34.1 0.08 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 128.636 2.774 . . . . 0.0 115.102 171.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.54 ' HG2' ' HB3' ' A' ' 10' ' ' ASP . 4.8 mt-30 -77.49 70.32 3.86 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 123.793 1.758 . . . . 0.0 113.019 169.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -65.49 -43.98 88.49 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 110.912 -2.858 . . . . 0.0 109.135 162.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 67.1 m -124.47 151.15 44.94 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -178.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -103.3 -75.64 0.61 Allowed 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 111.609 -2.541 . . . . 0.0 109.537 174.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -96.86 52.5 1.18 Allowed 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 123.18 1.467 . . . . 0.0 109.89 177.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.59 105.29 0.53 Allowed Glycine 0 CA--C 1.525 0.678 0 CA-C-N 112.224 -2.262 . . . . 0.0 110.515 -175.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.2 p -71.01 91.59 0.89 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 171.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 p -95.83 143.43 27.06 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 112.077 -2.329 . . . . 0.0 117.061 -166.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.528 ' HB3' ' HB2' ' A' ' 5' ' ' PHE . 0.0 OUTLIER -101.16 105.46 16.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 111.493 -2.594 . . . . 0.0 110.101 177.528 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.49 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 37.8 t80 -80.39 96.85 6.82 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 112.992 -1.913 . . . . 0.0 110.872 -174.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.7 mt -69.93 93.42 0.77 Allowed 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 112.804 -1.998 . . . . 0.0 110.752 172.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 4' ' ' HIS . 57.5 t -48.55 -52.0 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 126.105 1.762 . . . . 0.0 111.458 -169.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.9 mp0 -60.07 -17.87 42.62 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 -176.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -113.0 -11.37 13.39 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.784 1.634 . . . . 0.0 114.536 177.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.464 ' O ' ' HD3' ' A' ' 30' ' ' PRO . 3.1 t70 54.62 30.23 12.88 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 127.976 2.51 . . . . 0.0 114.269 -164.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -97.32 111.91 59.55 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 113.737 -1.574 . . . . 0.0 112.805 -167.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' A' ' 28' ' ' ASP . 17.4 Cg_exo -79.58 95.41 1.04 Allowed 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.081 2.521 . . . . 0.0 109.429 170.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -97.18 128.72 44.33 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-O 121.949 0.881 . . . . 0.0 110.921 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.8 m -110.97 136.6 49.73 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -149.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 61.9 t -92.79 103.43 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 160.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 96.6 m -59.84 131.5 51.07 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.555 170.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.5 ' HB2' ' HD1' ' A' ' 38' ' ' TYR . 22.3 m170 -56.11 137.13 52.0 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.691 0.619 . . . . 0.0 109.591 174.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 t -59.42 103.4 0.19 Allowed 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 121.519 0.676 . . . . 0.0 110.862 175.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.99 -13.32 5.52 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 114.183 -1.371 . . . . 0.0 115.971 -162.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.5 ' HD1' ' HB2' ' A' ' 35' ' ' HIS . 86.6 m-85 -129.64 151.29 50.41 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.07 0.948 . . . . 0.0 113.026 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.754 HG22 ' HB2' ' A' ' 47' ' ' ASP . 3.1 m -122.72 166.0 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 113.79 -1.55 . . . . 0.0 112.407 164.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 124.54 151.44 8.1 Favored Glycine 0 N--CA 1.475 1.288 0 CA-C-N 113.674 -1.603 . . . . 0.0 111.164 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.04 73.56 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 117.458 0.629 . . . . 0.0 111.596 172.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.34 -4.86 59.06 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.359 1.464 . . . . 0.0 112.683 174.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 68.7 m 44.33 81.63 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.113 1.765 . . . . 0.0 114.298 -173.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -142.08 -31.84 0.53 Allowed 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 112.674 -2.057 . . . . 0.0 116.329 -178.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.431 ' HB2' HG23 ' A' ' 39' ' ' VAL . 55.6 m-70 -83.58 104.49 13.75 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 -169.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.67 108.98 1.54 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -172.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.754 ' HB2' HG22 ' A' ' 39' ' ' VAL . 20.0 t0 . . . . . 0 CA--C 1.547 0.838 0 CA-C-N 111.894 -2.412 . . . . 0.0 105.165 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -134.81 57.65 1.8 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.287 1.435 . . . . 0.0 110.83 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -77.61 131.45 37.8 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 114.652 -1.158 . . . . 0.0 113.288 -165.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -49.64 106.83 0.12 Allowed 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.708 173.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 23.6 m -48.27 121.59 9.34 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.524 1.529 . . . . 0.0 114.733 -165.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -78.49 82.31 2.51 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 N-CA-C 107.262 -1.861 . . . . 0.0 107.262 157.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -60.7 106.22 0.54 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -164.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 m -168.0 101.75 0.46 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 127.471 2.309 . . . . 0.0 109.009 165.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 70.66 -39.36 0.44 Allowed 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 126.191 1.796 . . . . 0.0 112.871 -161.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.9 p -62.16 55.48 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 127.131 2.172 . . . . 0.0 112.49 157.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -125.13 -71.71 0.7 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.798 1.639 . . . . 0.0 112.698 -174.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.551 ' HB3' ' HB2' ' A' ' 30' ' ' PRO . 7.6 t80 51.61 -25.79 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 118.27 2.692 . . . . 0.0 118.27 -177.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.8 m -117.3 165.5 13.39 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.538 1.135 . . . . 0.0 113.985 170.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -86.82 -78.43 0.29 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 113.392 -1.731 . . . . 0.0 110.073 171.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -100.13 57.38 0.96 Allowed 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 122.937 1.351 . . . . 0.0 108.91 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -149.49 98.66 0.19 Allowed Glycine 0 CA--C 1.526 0.74 0 CA-C-N 112.235 -2.257 . . . . 0.0 111.519 -174.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.4 p -71.4 94.6 1.26 Allowed 'General case' 0 C--N 1.317 -0.846 0 O-C-N 125.411 1.3 . . . . 0.0 110.15 -177.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 32' ' ' CYS . 30.4 p -74.5 149.65 40.19 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 -169.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -112.09 122.02 46.58 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 112.486 -2.143 . . . . 0.0 109.035 166.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -84.4 105.16 15.02 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 113.073 -1.876 . . . . 0.0 111.71 -174.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.7 91.45 2.91 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 112.942 -1.936 . . . . 0.0 109.996 175.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.3 t -52.52 -60.12 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 125.17 1.388 . . . . 0.0 111.171 -169.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.496 ' H ' ' CD ' ' A' ' 26' ' ' GLN . 4.3 pm0 -55.34 -14.68 1.97 Allowed 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 116.999 2.222 . . . . 0.0 116.999 177.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -113.38 -7.66 13.47 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 125.049 1.34 . . . . 0.0 114.199 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.6 p30 52.21 29.25 6.35 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 127.647 2.379 . . . . 0.0 115.244 -170.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -119.03 122.6 29.5 Favored Pre-proline 0 N--CA 1.476 0.852 0 CA-C-N 113.51 -1.677 . . . . 0.0 112.361 -166.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.551 ' HB2' ' HB3' ' A' ' 15' ' ' PHE . 31.2 Cg_exo -74.65 133.4 17.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.066 1.844 . . . . 0.0 109.894 160.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -133.98 140.84 47.0 Favored 'General case' 0 N--CA 1.483 1.179 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.513 168.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 21' ' ' CYS . 60.1 m -108.67 137.75 46.1 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -152.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.2 t -81.73 92.88 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 CA-C-N 113.381 -1.736 . . . . 0.0 106.773 158.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 79.1 m -55.43 129.26 38.01 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.441 171.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 26.5 m170 -55.64 155.91 5.26 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.644 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.9 m -40.09 105.82 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 125.342 1.457 . . . . 0.0 114.264 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.15 10.44 83.79 Favored Glycine 0 CA--C 1.541 1.713 0 CA-C-N 113.757 -1.565 . . . . 0.0 116.298 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -90.26 134.54 34.24 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 122.713 1.244 . . . . 0.0 113.163 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.0 m -110.74 159.78 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-N 113.013 -1.903 . . . . 0.0 112.141 169.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.2 151.52 8.76 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 113.265 -1.789 . . . . 0.0 111.529 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.57 -33.63 76.03 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 115.067 -0.566 . . . . 0.0 111.87 175.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.63 6.86 44.14 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.205 1.402 . . . . 0.0 111.873 177.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 60.6 m 38.05 75.28 0.07 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.727 2.011 . . . . 0.0 113.056 -170.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -120.92 -35.07 3.41 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 113.487 -1.688 . . . . 0.0 115.197 -171.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -105.95 103.13 12.56 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 -163.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.71 114.67 6.51 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.45 1.119 . . . . 0.0 111.37 175.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.2 t0 . . . . . 0 N--CA 1.473 0.722 0 CA-C-N 112.723 -2.035 . . . . 0.0 110.884 -165.797 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.4 t60 . . . . . 0 N--CA 1.482 1.155 0 CA-C-O 121.236 0.541 . . . . 0.0 112.442 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.613 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . 52.2 p90 -114.25 -28.17 7.36 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 116.618 2.081 . . . . 0.0 116.618 -171.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 p30 38.79 -104.39 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -173.45 136.84 0.62 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.734 2.014 . . . . 0.0 110.536 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.596 ' HB2' ' HB2' ' A' ' 12' ' ' HIS . 26.7 p -73.64 137.45 77.27 Favored Pre-proline 0 N--CA 1.485 1.292 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 177.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -76.36 -179.61 5.45 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.408 2.739 . . . . 0.0 113.701 165.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -51.74 -41.4 61.52 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 -175.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 p -51.64 -33.43 33.39 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.764 1.269 . . . . 0.0 113.979 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.596 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 15.8 m-70 -106.85 -24.46 12.05 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.055 -1.429 . . . . 0.0 114.018 -168.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.3 p -63.98 -29.05 70.24 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 155.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -85.41 -12.46 51.98 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 117.465 2.395 . . . . 0.0 117.465 172.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -68.54 -62.02 1.57 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.255 146.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.462 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 80.5 m -91.86 80.33 5.24 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.043 0.925 . . . . 0.0 112.218 -176.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -56.91 -52.04 66.73 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 114.162 -1.381 . . . . 0.0 113.348 -169.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -117.54 49.04 1.26 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 123.142 1.449 . . . . 0.0 110.029 167.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.413 ' HA3' ' HB3' ' A' ' 16' ' ' CYS . . . -130.97 115.22 1.72 Allowed Glycine 0 N--CA 1.479 1.51 0 CA-C-N 112.632 -2.076 . . . . 0.0 110.279 178.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.6 p -74.62 80.28 2.0 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 113.943 -1.129 . . . . 0.0 109.776 170.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.462 ' HB3' ' SG ' ' A' ' 16' ' ' CYS . 1.3 p -77.56 147.66 35.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 112.237 -2.256 . . . . 0.0 116.958 -166.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.613 ' HB3' ' HB2' ' A' ' 5' ' ' PHE . 99.4 mtt180 -118.13 123.06 44.65 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 111.996 -2.366 . . . . 0.0 110.325 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -84.07 85.54 7.33 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 123.472 1.606 . . . . 0.0 109.304 178.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.431 ' HB3' HE22 ' A' ' 26' ' ' GLN . 15.5 mt -71.41 89.41 0.92 Allowed 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 112.151 -2.295 . . . . 0.0 111.957 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 14.1 t -58.06 -44.71 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 CA-C-N 112.842 -1.981 . . . . 0.0 111.581 -161.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.431 HE22 ' HB3' ' A' ' 24' ' ' LEU . 4.0 pm0 -56.89 -22.2 35.4 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.968 2.21 . . . . 0.0 116.968 178.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -115.33 1.32 13.72 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.4 p30 49.57 29.44 3.0 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.418 2.687 . . . . 0.0 115.353 -166.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -97.04 109.08 47.53 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 113.318 -1.764 . . . . 0.0 112.947 -165.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.478 ' HB2' ' HB3' ' A' ' 12' ' ' HIS . 58.4 Cg_endo -83.9 48.78 2.65 Favored 'Trans proline' 0 N--CA 1.488 1.185 0 C-N-CA 122.714 2.276 . . . . 0.0 113.725 -177.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.81 148.85 32.74 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -165.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.0 m -82.87 143.32 30.84 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.254 -1.339 . . . . 0.0 113.083 -165.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.4 t -100.74 102.07 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 152.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.523 ' SG ' ' HA2' ' A' ' 40' ' ' GLY . 98.9 m -57.58 134.7 56.37 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 120.96 0.41 . . . . 0.0 111.888 177.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -56.51 164.22 1.49 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 114.406 -1.27 . . . . 0.0 111.758 174.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.6 p -51.09 107.77 0.2 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.075 1.35 . . . . 0.0 113.414 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.4 20.49 62.16 Favored Glycine 0 CA--C 1.543 1.804 0 CA-C-N 113.988 -1.46 . . . . 0.0 115.569 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -107.49 153.09 23.33 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 174.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.516 HG23 ' HB2' ' A' ' 45' ' ' HIS . 3.9 m -119.56 165.21 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 177.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.523 ' HA2' ' SG ' ' A' ' 34' ' ' CYS . . . -104.77 -148.2 17.7 Favored Glycine 0 N--CA 1.476 1.333 0 N-CA-C 119.234 2.454 . . . . 0.0 119.234 -129.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.44 ' HB3' HH11 ' A' ' 42' ' ' ARG . . . 61.73 -67.72 0.06 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 111.604 -2.298 . . . . 0.0 113.683 -160.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.44 HH11 ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -110.87 -3.62 15.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.861 1.664 . . . . 0.0 114.922 174.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 39' ' ' VAL . 33.5 m 45.61 68.08 0.64 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 126.136 1.775 . . . . 0.0 111.471 -176.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -120.65 22.38 11.21 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-O 122.568 1.175 . . . . 0.0 111.072 172.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.516 ' HB2' HG23 ' A' ' 39' ' ' VAL . 16.4 m-70 -140.51 144.59 36.07 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 -165.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.0 142.87 34.97 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.6 0.563 . . . . 0.0 111.322 174.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 t70 . . . . . 0 N--CA 1.48 1.038 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.761 -177.734 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 CA--C 1.548 0.873 0 CA-C-O 122.225 1.012 . . . . 0.0 113.149 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 49.7 t 61.08 109.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 CA-C-N 113.027 -1.897 . . . . 0.0 110.826 177.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.0 p -42.21 -56.66 2.82 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 -162.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -49.24 -39.38 30.04 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.964 1.306 . . . . 0.0 114.375 176.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -87.01 -69.1 0.7 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.871 1.268 . . . . 0.0 110.149 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.679 HD21 ' HB2' ' A' ' 8' ' ' CYS . 25.8 t-20 -137.73 154.05 49.67 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 116.019 1.859 . . . . 0.0 116.019 176.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -166.02 95.47 0.59 Allowed 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 110.329 -3.123 . . . . 0.0 109.17 158.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.679 ' HB2' HD21 ' A' ' 6' ' ' ASN . 33.0 t -113.78 140.56 24.84 Favored Pre-proline 0 CA--C 1.55 0.972 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -173.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -57.91 172.25 1.26 Allowed 'Trans proline' 0 N--CA 1.481 0.778 0 C-N-CA 124.325 3.35 . . . . 0.0 112.246 160.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -125.33 -47.16 1.75 Allowed 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 116.351 1.982 . . . . 0.0 116.351 175.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 56.8 p -67.63 93.49 0.37 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.137 0.975 . . . . 0.0 110.879 167.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 2.4 t60 52.21 99.02 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 124.004 1.859 . . . . 0.0 111.398 -149.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.472 HG22 ' O ' ' A' ' 16' ' ' CYS . 3.0 t -83.68 47.1 1.23 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 112.06 -2.336 . . . . 0.0 111.817 -176.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 64.89 -46.82 0.34 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 126.872 2.069 . . . . 0.0 116.375 -172.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -90.76 -52.22 4.98 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.093 1.357 . . . . 0.0 112.797 172.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.472 ' O ' HG22 ' A' ' 13' ' ' THR . 38.6 m -117.7 148.54 41.89 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -166.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -63.37 -59.6 4.48 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 114.807 -1.088 . . . . 0.0 113.651 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -115.26 63.45 0.68 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 123.362 1.553 . . . . 0.0 111.242 175.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.63 164.77 16.64 Favored Glycine 0 N--CA 1.476 1.302 0 CA-C-N 111.789 -2.459 . . . . 0.0 111.058 175.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.9 p -125.26 95.48 4.49 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 112.815 -1.693 . . . . 0.0 109.47 169.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.48 ' SG ' ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -87.94 141.52 28.51 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 116.754 2.131 . . . . 0.0 116.754 -163.003 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -85.94 81.28 8.58 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 112.13 -2.305 . . . . 0.0 107.261 157.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.48 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 26.5 t80 -69.52 89.91 0.53 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 112.587 -2.097 . . . . 0.0 107.945 163.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 76.2 mt -64.2 88.55 0.05 Allowed 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 112.753 -2.021 . . . . 0.0 108.753 172.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.414 HG23 ' HA ' ' A' ' 6' ' ' ASN . 84.0 t -55.71 -48.97 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-N 112.304 -2.225 . . . . 0.0 110.95 -166.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -26.61 66.31 Favored 'General case' 0 CA--C 1.554 1.116 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -92.84 -15.54 26.36 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 126.786 2.034 . . . . 0.0 115.186 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 p30 55.55 34.26 22.77 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.947 2.499 . . . . 0.0 115.876 -167.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -118.37 109.98 39.79 Favored Pre-proline 0 N--CA 1.486 1.357 0 CA-C-N 114.022 -1.445 . . . . 0.0 113.135 -172.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 96.5 Cg_endo -88.22 128.48 2.24 Favored 'Trans proline' 0 N--CA 1.481 0.735 0 C-N-CA 121.151 1.234 . . . . 0.0 113.774 170.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -139.7 145.54 38.49 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 114.776 -1.102 . . . . 0.0 113.532 168.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.0 m -112.5 143.38 43.75 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -148.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.3 t -94.32 101.89 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-N 113.334 -1.757 . . . . 0.0 106.977 155.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.4 m -57.26 140.14 50.72 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 177.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -56.47 160.55 3.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 121.806 0.813 . . . . 0.0 112.566 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.9 p -53.02 107.81 0.26 Allowed 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 114.272 -1.331 . . . . 0.0 112.779 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.14 26.41 52.66 Favored Glycine 0 N--CA 1.484 1.835 0 CA-C-N 114.108 -1.406 . . . . 0.0 115.318 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -117.77 153.07 34.05 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.814 0.846 . . . . 0.0 113.178 172.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.646 HG23 ' HB2' ' A' ' 45' ' ' HIS . 8.5 m -121.2 165.98 16.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -111.03 -142.08 8.92 Favored Glycine 0 CA--C 1.535 1.313 0 N-CA-C 119.001 2.36 . . . . 0.0 119.001 -129.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 60.16 -75.09 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 126.595 1.958 . . . . 0.0 112.109 -154.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.8 ttt180 -113.32 30.23 7.37 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.974 176.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 16' ' ' CYS . 34.5 m 23.48 62.93 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 128.492 2.717 . . . . 0.0 113.527 -175.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -93.11 -26.48 17.43 Favored 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 113.471 -1.695 . . . . 0.0 112.473 -176.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.646 ' HB2' HG23 ' A' ' 39' ' ' VAL . 43.4 m-70 -115.2 146.9 40.96 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -156.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.466 ' HB3' ' O ' ' A' ' 49' ' ' LEU . . . -78.58 151.82 32.19 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.517 0.675 . . . . 0.0 111.946 164.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -59.11 100.31 0.07 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.065 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 31.1 tp 82.13 -44.87 0.16 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 112.156 -2.293 . . . . 0.0 112.359 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.466 ' O ' ' HB3' ' A' ' 46' ' ' ALA . 6.0 mp -83.11 54.47 2.78 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.125 1.77 . . . . 0.0 110.088 173.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.333 0 CA-C-O 115.998 -1.953 . . . . 0.0 116.202 -171.873 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 115.598 1.703 . . . . 0.0 115.598 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 43.4 t -65.08 100.12 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.186 1.394 . . . . 0.0 109.388 -174.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.5 p -152.69 -76.12 0.13 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.46 1.281 . . . . 0.0 114.46 -170.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.405 ' O ' HG23 ' A' ' 25' ' ' VAL . 63.3 m80 -87.89 92.56 9.17 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.267 0.556 . . . . 0.0 111.394 -167.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.528 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . 44.9 p90 -95.69 121.9 37.88 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 114.288 -1.324 . . . . 0.0 113.031 175.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -114.36 174.76 5.79 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 113.996 -1.457 . . . . 0.0 113.336 172.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -69.84 103.11 2.11 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 121.159 0.504 . . . . 0.0 111.788 173.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 23' ' ' PHE . 26.5 p -48.32 120.01 8.1 Favored Pre-proline 0 N--CA 1.481 1.099 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -164.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.488 ' HD2' ' HA ' ' A' ' 8' ' ' CYS . 55.6 Cg_endo -73.69 98.23 1.04 Allowed 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 122.176 1.917 . . . . 0.0 110.261 153.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.54 ' HB3' ' HG2' ' A' ' 14' ' ' GLN . 1.9 m-20 -102.42 100.96 11.14 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 114.068 -1.424 . . . . 0.0 111.861 171.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 p -125.64 -89.71 0.56 Allowed 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 113.576 -1.647 . . . . 0.0 110.687 172.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.458 ' HD2' HG23 ' A' ' 13' ' ' THR . 1.4 p-80 -55.78 -40.92 73.3 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.563 1.145 . . . . 0.0 111.696 158.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.458 HG23 ' HD2' ' A' ' 12' ' ' HIS . 4.1 p -73.63 34.1 0.08 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 128.636 2.774 . . . . 0.0 115.102 171.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.54 ' HG2' ' HB3' ' A' ' 10' ' ' ASP . 4.8 mt-30 -77.49 70.32 3.86 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 123.793 1.758 . . . . 0.0 113.019 169.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -65.49 -43.98 88.49 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 110.912 -2.858 . . . . 0.0 109.135 162.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 67.1 m -124.47 151.15 44.94 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -178.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -103.3 -75.64 0.61 Allowed 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 111.609 -2.541 . . . . 0.0 109.537 174.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -96.86 52.5 1.18 Allowed 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 123.18 1.467 . . . . 0.0 109.89 177.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.59 105.29 0.53 Allowed Glycine 0 CA--C 1.525 0.678 0 CA-C-N 112.224 -2.262 . . . . 0.0 110.515 -175.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.2 p -71.01 91.59 0.89 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 171.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 p -95.83 143.43 27.06 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 112.077 -2.329 . . . . 0.0 117.061 -166.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.528 ' HB3' ' HB2' ' A' ' 5' ' ' PHE . 0.0 OUTLIER -101.16 105.46 16.61 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 111.493 -2.594 . . . . 0.0 110.101 177.528 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.49 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 37.8 t80 -80.39 96.85 6.82 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 112.992 -1.913 . . . . 0.0 110.872 -174.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.7 mt -69.93 93.42 0.77 Allowed 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 112.804 -1.998 . . . . 0.0 110.752 172.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 4' ' ' HIS . 57.5 t -48.55 -52.0 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 126.105 1.762 . . . . 0.0 111.458 -169.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.9 mp0 -60.07 -17.87 42.62 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 -176.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -113.0 -11.37 13.39 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.784 1.634 . . . . 0.0 114.536 177.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.464 ' O ' ' HD3' ' A' ' 30' ' ' PRO . 3.1 t70 54.62 30.23 12.88 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 127.976 2.51 . . . . 0.0 114.269 -164.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -97.32 111.91 59.55 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 113.737 -1.574 . . . . 0.0 112.805 -167.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' A' ' 28' ' ' ASP . 17.4 Cg_exo -79.58 95.41 1.04 Allowed 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.081 2.521 . . . . 0.0 109.429 170.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -97.18 128.72 44.33 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-O 121.949 0.881 . . . . 0.0 110.921 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.8 m -110.97 136.6 49.73 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -149.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 61.9 t -92.79 103.43 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 160.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 96.6 m -59.84 131.5 51.07 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.555 170.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.5 ' HB2' ' HD1' ' A' ' 38' ' ' TYR . 22.3 m170 -56.11 137.13 52.0 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.691 0.619 . . . . 0.0 109.591 174.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 t -59.42 103.4 0.19 Allowed 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 121.519 0.676 . . . . 0.0 110.862 175.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.99 -13.32 5.52 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 114.183 -1.371 . . . . 0.0 115.971 -162.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.5 ' HD1' ' HB2' ' A' ' 35' ' ' HIS . 86.6 m-85 -129.64 151.29 50.41 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.07 0.948 . . . . 0.0 113.026 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.754 HG22 ' HB2' ' A' ' 47' ' ' ASP . 3.1 m -122.72 166.0 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 113.79 -1.55 . . . . 0.0 112.407 164.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 124.54 151.44 8.1 Favored Glycine 0 N--CA 1.475 1.288 0 CA-C-N 113.674 -1.603 . . . . 0.0 111.164 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.04 73.56 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 117.458 0.629 . . . . 0.0 111.596 172.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.34 -4.86 59.06 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.359 1.464 . . . . 0.0 112.683 174.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 68.7 m 44.33 81.63 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.113 1.765 . . . . 0.0 114.298 -173.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -142.08 -31.84 0.53 Allowed 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 112.674 -2.057 . . . . 0.0 116.329 -178.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.431 ' HB2' HG23 ' A' ' 39' ' ' VAL . 55.6 m-70 -83.58 104.49 13.75 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 -169.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.67 108.98 1.54 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -172.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.754 ' HB2' HG22 ' A' ' 39' ' ' VAL . 20.0 t0 -108.48 87.13 2.42 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 111.894 -2.412 . . . . 0.0 105.165 177.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 61.2 mt -74.41 64.18 1.12 Allowed 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 118.249 2.685 . . . . 0.0 118.249 -152.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -85.82 46.0 1.27 Allowed 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 112.984 -1.916 . . . . 0.0 110.809 166.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-N 113.737 -1.574 . . . . 0.0 114.837 -174.066 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.484 1.246 0 CA-C-O 122.635 1.207 . . . . 0.0 113.23 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.1 t -49.22 -45.21 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 CA-C-N 113.271 -1.786 . . . . 0.0 113.249 -168.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.2 t -48.63 -41.28 30.6 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -66.08 -23.81 66.59 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -134.81 57.65 1.8 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.287 1.435 . . . . 0.0 110.83 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -77.61 131.45 37.8 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 114.652 -1.158 . . . . 0.0 113.288 -165.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -49.64 106.83 0.12 Allowed 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.708 173.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 23.6 m -48.27 121.59 9.34 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.524 1.529 . . . . 0.0 114.733 -165.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -78.49 82.31 2.51 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 N-CA-C 107.262 -1.861 . . . . 0.0 107.262 157.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -60.7 106.22 0.54 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -164.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 m -168.0 101.75 0.46 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 127.471 2.309 . . . . 0.0 109.009 165.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 70.66 -39.36 0.44 Allowed 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 126.191 1.796 . . . . 0.0 112.871 -161.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.9 p -62.16 55.48 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 127.131 2.172 . . . . 0.0 112.49 157.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -125.13 -71.71 0.7 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.798 1.639 . . . . 0.0 112.698 -174.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.551 ' HB3' ' HB2' ' A' ' 30' ' ' PRO . 7.6 t80 51.61 -25.79 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 118.27 2.692 . . . . 0.0 118.27 -177.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.8 m -117.3 165.5 13.39 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.538 1.135 . . . . 0.0 113.985 170.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -86.82 -78.43 0.29 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 113.392 -1.731 . . . . 0.0 110.073 171.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -100.13 57.38 0.96 Allowed 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 122.937 1.351 . . . . 0.0 108.91 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -149.49 98.66 0.19 Allowed Glycine 0 CA--C 1.526 0.74 0 CA-C-N 112.235 -2.257 . . . . 0.0 111.519 -174.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.4 p -71.4 94.6 1.26 Allowed 'General case' 0 C--N 1.317 -0.846 0 O-C-N 125.411 1.3 . . . . 0.0 110.15 -177.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 32' ' ' CYS . 30.4 p -74.5 149.65 40.19 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 -169.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -112.09 122.02 46.58 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 112.486 -2.143 . . . . 0.0 109.035 166.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -84.4 105.16 15.02 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 113.073 -1.876 . . . . 0.0 111.71 -174.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.7 91.45 2.91 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 112.942 -1.936 . . . . 0.0 109.996 175.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.3 t -52.52 -60.12 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 125.17 1.388 . . . . 0.0 111.171 -169.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.496 ' H ' ' CD ' ' A' ' 26' ' ' GLN . 4.3 pm0 -55.34 -14.68 1.97 Allowed 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 116.999 2.222 . . . . 0.0 116.999 177.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -113.38 -7.66 13.47 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 125.049 1.34 . . . . 0.0 114.199 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.6 p30 52.21 29.25 6.35 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 127.647 2.379 . . . . 0.0 115.244 -170.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -119.03 122.6 29.5 Favored Pre-proline 0 N--CA 1.476 0.852 0 CA-C-N 113.51 -1.677 . . . . 0.0 112.361 -166.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.551 ' HB2' ' HB3' ' A' ' 15' ' ' PHE . 31.2 Cg_exo -74.65 133.4 17.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.066 1.844 . . . . 0.0 109.894 160.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -133.98 140.84 47.0 Favored 'General case' 0 N--CA 1.483 1.179 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.513 168.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 21' ' ' CYS . 60.1 m -108.67 137.75 46.1 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -152.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 91.2 t -81.73 92.88 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 CA-C-N 113.381 -1.736 . . . . 0.0 106.773 158.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 79.1 m -55.43 129.26 38.01 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.441 171.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 26.5 m170 -55.64 155.91 5.26 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.644 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.9 m -40.09 105.82 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 125.342 1.457 . . . . 0.0 114.264 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.15 10.44 83.79 Favored Glycine 0 CA--C 1.541 1.713 0 CA-C-N 113.757 -1.565 . . . . 0.0 116.298 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -90.26 134.54 34.24 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 122.713 1.244 . . . . 0.0 113.163 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.0 m -110.74 159.78 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-N 113.013 -1.903 . . . . 0.0 112.141 169.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.2 151.52 8.76 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 113.265 -1.789 . . . . 0.0 111.529 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.57 -33.63 76.03 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 115.067 -0.566 . . . . 0.0 111.87 175.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.63 6.86 44.14 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.205 1.402 . . . . 0.0 111.873 177.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 60.6 m 38.05 75.28 0.07 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.727 2.011 . . . . 0.0 113.056 -170.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -120.92 -35.07 3.41 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 113.487 -1.688 . . . . 0.0 115.197 -171.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -105.95 103.13 12.56 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 -163.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.71 114.67 6.51 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.45 1.119 . . . . 0.0 111.37 175.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -77.36 96.63 4.68 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 112.723 -2.035 . . . . 0.0 110.884 -165.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.6 mt -47.32 -37.03 10.17 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 170.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.6 mt -91.94 66.79 5.1 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 123.151 1.453 . . . . 0.0 108.256 171.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.39 0 CA-C-N 112.314 -2.221 . . . . 0.0 114.867 178.632 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 122.868 1.318 . . . . 0.0 114.079 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.8 t -78.72 97.93 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.823 -174.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.0 p -66.07 85.76 0.09 Allowed 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 114.41 -1.268 . . . . 0.0 112.837 174.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -162.52 155.07 19.3 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 114.166 -1.379 . . . . 0.0 112.442 -178.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.613 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . 52.2 p90 -114.25 -28.17 7.36 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 116.618 2.081 . . . . 0.0 116.618 -171.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 p30 38.79 -104.39 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -173.45 136.84 0.62 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.734 2.014 . . . . 0.0 110.536 -175.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.596 ' HB2' ' HB2' ' A' ' 12' ' ' HIS . 26.7 p -73.64 137.45 77.27 Favored Pre-proline 0 N--CA 1.485 1.292 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 177.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -76.36 -179.61 5.45 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.408 2.739 . . . . 0.0 113.701 165.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -51.74 -41.4 61.52 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 -175.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 p -51.64 -33.43 33.39 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.764 1.269 . . . . 0.0 113.979 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.596 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 15.8 m-70 -106.85 -24.46 12.05 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.055 -1.429 . . . . 0.0 114.018 -168.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.3 p -63.98 -29.05 70.24 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 155.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -85.41 -12.46 51.98 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 117.465 2.395 . . . . 0.0 117.465 172.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -68.54 -62.02 1.57 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.255 146.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.462 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 80.5 m -91.86 80.33 5.24 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.043 0.925 . . . . 0.0 112.218 -176.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -56.91 -52.04 66.73 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 114.162 -1.381 . . . . 0.0 113.348 -169.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -117.54 49.04 1.26 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 123.142 1.449 . . . . 0.0 110.029 167.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.413 ' HA3' ' HB3' ' A' ' 16' ' ' CYS . . . -130.97 115.22 1.72 Allowed Glycine 0 N--CA 1.479 1.51 0 CA-C-N 112.632 -2.076 . . . . 0.0 110.279 178.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.6 p -74.62 80.28 2.0 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 113.943 -1.129 . . . . 0.0 109.776 170.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.462 ' HB3' ' SG ' ' A' ' 16' ' ' CYS . 1.3 p -77.56 147.66 35.6 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 112.237 -2.256 . . . . 0.0 116.958 -166.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.613 ' HB3' ' HB2' ' A' ' 5' ' ' PHE . 99.4 mtt180 -118.13 123.06 44.65 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 111.996 -2.366 . . . . 0.0 110.325 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -84.07 85.54 7.33 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 123.472 1.606 . . . . 0.0 109.304 178.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.431 ' HB3' HE22 ' A' ' 26' ' ' GLN . 15.5 mt -71.41 89.41 0.92 Allowed 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 112.151 -2.295 . . . . 0.0 111.957 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 14.1 t -58.06 -44.71 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 CA-C-N 112.842 -1.981 . . . . 0.0 111.581 -161.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.431 HE22 ' HB3' ' A' ' 24' ' ' LEU . 4.0 pm0 -56.89 -22.2 35.4 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.968 2.21 . . . . 0.0 116.968 178.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -115.33 1.32 13.72 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.4 p30 49.57 29.44 3.0 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.418 2.687 . . . . 0.0 115.353 -166.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -97.04 109.08 47.53 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 113.318 -1.764 . . . . 0.0 112.947 -165.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.478 ' HB2' ' HB3' ' A' ' 12' ' ' HIS . 58.4 Cg_endo -83.9 48.78 2.65 Favored 'Trans proline' 0 N--CA 1.488 1.185 0 C-N-CA 122.714 2.276 . . . . 0.0 113.725 -177.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.81 148.85 32.74 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -165.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.0 m -82.87 143.32 30.84 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.254 -1.339 . . . . 0.0 113.083 -165.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.4 t -100.74 102.07 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 152.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.523 ' SG ' ' HA2' ' A' ' 40' ' ' GLY . 98.9 m -57.58 134.7 56.37 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 120.96 0.41 . . . . 0.0 111.888 177.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -56.51 164.22 1.49 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 114.406 -1.27 . . . . 0.0 111.758 174.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.6 p -51.09 107.77 0.2 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.075 1.35 . . . . 0.0 113.414 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.4 20.49 62.16 Favored Glycine 0 CA--C 1.543 1.804 0 CA-C-N 113.988 -1.46 . . . . 0.0 115.569 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -107.49 153.09 23.33 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 174.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.516 HG23 ' HB2' ' A' ' 45' ' ' HIS . 3.9 m -119.56 165.21 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 177.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.523 ' HA2' ' SG ' ' A' ' 34' ' ' CYS . . . -104.77 -148.2 17.7 Favored Glycine 0 N--CA 1.476 1.333 0 N-CA-C 119.234 2.454 . . . . 0.0 119.234 -129.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.44 ' HB3' HH11 ' A' ' 42' ' ' ARG . . . 61.73 -67.72 0.06 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 111.604 -2.298 . . . . 0.0 113.683 -160.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.44 HH11 ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -110.87 -3.62 15.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.861 1.664 . . . . 0.0 114.922 174.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 39' ' ' VAL . 33.5 m 45.61 68.08 0.64 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 126.136 1.775 . . . . 0.0 111.471 -176.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -120.65 22.38 11.21 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-O 122.568 1.175 . . . . 0.0 111.072 172.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.516 ' HB2' HG23 ' A' ' 39' ' ' VAL . 16.4 m-70 -140.51 144.59 36.07 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 -165.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.0 142.87 34.97 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.6 0.563 . . . . 0.0 111.322 174.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -73.91 83.98 1.71 Allowed 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.761 -177.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.8 mt -73.56 76.46 1.47 Allowed 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 113.655 -1.611 . . . . 0.0 111.404 173.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -170.77 -60.05 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 111.842 -2.436 . . . . 0.0 107.66 -172.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.09 0 CA-C-O 117.127 -1.416 . . . . 0.0 113.321 166.297 . . . . . . . . 0 0 . 1 stop_ save_